(2R)-N-(4-acetamidophenyl)-2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(4-acetamidophenyl)-2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(4-acetamidophenyl)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(4-acetamidophenyl)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(4-acetamidophenyl)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(4-acetamidophenyl)-2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H20N6O2S MolecularWeight: 360.434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2N)C3CC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C16H20N6O2S/c1-9(25-16-21-20-14(22(16)17)11-3-4-11)15(24)19-13-7-5-12(6-8-13)18-10(2)23/h5-9,11H,3-4,17H2,1-2H3,(H,18,23)(H,19,24)/t9-/m1/s1