(2R)-N-(4-dimethylaminophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(4-dimethylaminophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(4-dimethylaminophenyl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-(4-dimethylaminophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(4-dimethylaminophenyl)-2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(4-dimethylaminophenyl)-2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SC(C)C(=O)NC2=CC=C(C=C2)N(C)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N(C)C)SC2=NNC(=N2)C(C)C

InChI

InChI=1S/C16H23N5OS/c1-10(2)14-18-16(20-19-14)23-11(3)15(22)17-12-6-8-13(9-7-12)21(4)5/h6-11H,1-5H3,(H,17,22)(H,18,19,20)/t11-/m1/s1