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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(5-phenylazanyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-bromo-4-methyl-phenyl)propanamide CAS Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(2-bromo-4-methylphenyl)propanamide IUPAC Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-bromo-4-methylphenyl)propanamide Traditional Name: 2-[(5-anilino-1,3,4-thiadiazol-2-yl)thio]-N-(2-bromo-4-methyl-phenyl)propionamide Formula: C18H17BrN4OS2 MolecularWeight: 449.38778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NC3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NN=C(S2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C18H17BrN4OS2/c1-11-8-9-15(14(19)10-11)21-16(24)12(2)25-18-23-22-17(26-18)20-13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H,20,22)(H,21,24)