4-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-3-nitro-benzamide

Systemtic Name: 4-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-3-nitro-benzamide Openeye Name: 4-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: 4-[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]-3-nitrobenzamide IUPAC Name: 4-(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanyl-3-nitrobenzamide Traditional Name: 4-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]-3-nitro-benzamide Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=CN=C2SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CC1N2C(=CN=C2SC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O3S/c20-18(24)13-6-9-17(15(10-13)23(25)26)27-19-21-11-16(22(19)14-7-8-14)12-4-2-1-3-5-12/h1-6,9-11,14H,7-8H2,(H2,20,24)