(2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-methoxy-4-nitro-phenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxy-4-nitro-phenyl)propanamide CAS Name: (2R)-N-(2-methoxy-4-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(2-methoxy-4-nitrophenyl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-2-[(4-allyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxy-4-nitro-phenyl)propionamide Formula: C15H17N5O4S MolecularWeight: 363.39158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)SC2=NN=CN2CC=C

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC)SC2=NN=CN2CC=C

InChI

InChI=1S/C15H17N5O4S/c1-4-7-19-9-16-18-15(19)25-10(2)14(21)17-12-6-5-11(20(22)23)8-13(12)24-3/h4-6,8-10H,1,7H2,2-3H3,(H,17,21)/t10-/m1/s1