N-methyl-3-nitro-4-phenylazanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: N-methyl-3-nitro-4-phenylazanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 4-anilino-N-methyl-3-nitro-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 4-anilino-N-methyl-3-nitro-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 4-anilino-N-methyl-3-nitro-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 4-anilino-N-methyl-3-nitro-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C24H22N6O3 MolecularWeight: 442.46988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=NC=N2)N(C)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H22N6O3/c1-17(18-8-11-21(12-9-18)29-16-25-15-26-29)28(2)24(31)19-10-13-22(23(14-19)30(32)33)27-20-6-4-3-5-7-20/h3-17,27H,1-2H3/t17-/m0/s1