N-(4-methyl-3-nitro-phenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: N-(4-methyl-3-nitrophenyl)-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]propionamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=C(N2C)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=C(N2C)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13-9-10-16(11-17(13)24(26)27)22-19(25)14(2)28-20-21-12-18(23(20)3)15-7-5-4-6-8-15/h4-12,14H,1-3H3,(H,22,25)