N-(3-acetamidophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(3-acetamidophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(3-acetamidophenyl)-3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(3-acetamidophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-acetamidophenyl)-3-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-acetamidophenyl)-3-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC(=C2)NC(=O)C

Isomeric SMILES

CC1=NN=C(N1CC=C)SCCC(=O)NC2=CC=CC(=C2)NC(=O)C

InChI

InChI=1S/C17H21N5O2S/c1-4-9-22-12(2)20-21-17(22)25-10-8-16(24)19-15-7-5-6-14(11-15)18-13(3)23/h4-7,11H,1,8-10H2,2-3H3,(H,18,23)(H,19,24)