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N,N-dibenzyl(dibenzylcarbamothioyl)disulfanylcarbothioamide

N,N-dibenzyl(dibenzylcarbamothioyl)disulfanylcarbothioamide

Formula: C30H28N2S4

SMILES: S=C(SSC(=S)N(CC1=CC=CC=C1)CC1=CC=CC=C1)N(CC1=CC=CC=C1)CC1=CC=CC=C1

IUPAC: N,N-dibenzyl[(dibenzylcarbamothioyl)disulfanyl]carbothioamide

InChI: InChI=1S/C30H28N2S4/c33-29(31(21-25-13-5-1-6-14-25)22-26-15-7-2-8-16-26)35-36-30(34)32(23-27-17-9-3-10-18-27)24-28-19-11-4-12-20-28/h1-20H,21-24H2

Composition: C (66.14%), H (5.18%), N (5.14%), S (23.54%)

Molar Mass: 544.81

Atom Count: 64

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 544.113533606
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey WITDFSFZHZYQHB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 167.69
Topological Polar Surface Area 6.48
Polarizability 65.73
Ring Count 4
Rotatable Bond Count 11

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97% <7 Days C30H28N2S4 $36.47-$320.71$36.47$103.79$320.71
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