1-benzyl-3-(carbamothioylamino)thiourea

1-benzyl-3-(carbamothioylamino)thiourea

Formula: C9H12N4S2

SMILES: NC(=S)NNC(=S)NCC1=CC=CC=C1

IUPAC: 1-benzyl-3-(carbamothioylamino)thiourea

InChI: InChI=1S/C9H12N4S2/c10-8(14)12-13-9(15)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,10,12,14)(H2,11,13,15)

Composition: C (44.98%), H (5.03%), N (23.31%), S (26.68%)

Molar Mass: 240.34

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	240.05033875
Formal Charge	0
FSP3	0.11
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	4
InChIKey	YJUCEFSSIIAPSM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.18
Topological Polar Surface Area	62.11
Polarizability	27.28
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C9H12N4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00