N-(4-bromanyl-3-methyl-phenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)thio]propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[(4-phenyl-5-sulfanylidene-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[(4-phenyl-5-thioxo-1,3,4-thiadiazol-2-yl)thio]propionamide Formula: C18H16BrN3OS3 MolecularWeight: 466.43814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16BrN3OS3/c1-11-10-13(8-9-15(11)19)20-16(23)12(2)25-17-21-22(18(24)26-17)14-6-4-3-5-7-14/h3-10,12H,1-2H3,(H,20,23)