N-cyclopentyl-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-cyclopentyl-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: N-cyclopentyl-2-[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanyl-propanamide CAS Name: N-cyclopentyl-2-[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]propanamide IUPAC Name: N-cyclopentyl-2-[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylpropanamide Traditional Name: N-cyclopentyl-2-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]propionamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)SC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1CCCC1)SC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4S/c1-14(21(27)23-15-7-3-4-8-15)31-22-24-17-13-16(26(28)29)11-12-18(17)25(22)19-9-5-6-10-20(19)30-2/h5-6,9-15H,3-4,7-8H2,1-2H3,(H,23,27)