3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazole

3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazole

CAS: 1119452-70-8

Formula: C6H6N4OS2

SMILES: CC1=NN=C(SCC2=NOC=N2)S1

IUPAC: 3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-1,2,4-oxadiazole

InChI: InChI=1S/C6H6N4OS2/c1-4-8-9-6(13-4)12-2-5-7-3-11-10-5/h3H,2H2,1H3

Composition: C (33.63%), H (2.82%), N (26.15%), O (7.47%), S (29.93%)

Molar Mass: 214.26

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	213.998303177
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NHLOJPHPIZXVQO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.95
Topological Polar Surface Area	64.7
Polarizability	18.81
Ring Count	2
Rotatable Bond Count	3

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