N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzamide Openeye Name: N-[2-(4,5-diphenyl-1-propyl-imidazol-2-yl)sulfanylethyl]-3-nitro-benzamide CAS Name: N-[2-[(4,5-diphenyl-1-propyl-2-imidazolyl)thio]ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(4,5-diphenyl-1-propylimidazol-2-yl)sulfanylethyl]-3-nitrobenzamide Traditional Name: N-[2-[(4,5-diphenyl-1-propyl-imidazol-2-yl)thio]ethyl]-3-nitro-benzamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(N=C1SCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=C(N=C1SCCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S/c1-2-17-30-25(21-12-7-4-8-13-21)24(20-10-5-3-6-11-20)29-27(30)35-18-16-28-26(32)22-14-9-15-23(19-22)31(33)34/h3-15,19H,2,16-18H2,1H3,(H,28,32)