N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]propanamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]propionamide Formula: C19H18ClN3OS3 MolecularWeight: 436.01372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)C(C)SC2=NN(C(=S)S2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H18ClN3OS3/c1-11-9-12(2)16(15(20)10-11)21-17(24)13(3)26-18-22-23(19(25)27-18)14-7-5-4-6-8-14/h4-10,13H,1-3H3,(H,21,24)