2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-dimethylaminophenyl)propanamide

Systemtic Name: 2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-dimethylaminophenyl)propanamide Openeye Name: 2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-dimethylaminophenyl)propanamide CAS Name: 2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-dimethylaminophenyl)propanamide IUPAC Name: 2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-dimethylaminophenyl)propanamide Traditional Name: 2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-dimethylaminophenyl)propionamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N(C)C)SC2=NN=CN2C3CC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N(C)C)SC2=NN=CN2C3CC3

InChI

InChI=1S/C16H21N5OS/c1-11(23-16-19-17-10-21(16)14-8-9-14)15(22)18-12-4-6-13(7-5-12)20(2)3/h4-7,10-11,14H,8-9H2,1-3H3,(H,18,22)