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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromo-3-methyl-phenyl)acetamide CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(4-bromo-3-methylphenyl)acetamide IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(4-bromo-3-methylphenyl)acetamide Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(4-bromo-3-methyl-phenyl)acetamide Formula: C17H15BrN4OS2 MolecularWeight: 435.3612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(S2)NC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(S2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C17H15BrN4OS2/c1-11-9-13(7-8-14(11)18)19-15(23)10-24-17-22-21-16(25-17)20-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,19,23)(H,20,21)