N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-(4-nitrophenyl)sulfanyl-propanamide

Systemtic Name: N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-(4-nitrophenyl)sulfanyl-propanamide Openeye Name: N-[[2-(cyclopentoxy)-3-pyridyl]methyl]-2-(4-nitrophenyl)sulfanyl-propanamide CAS Name: N-[(2-cyclopentyloxy-3-pyridinyl)methyl]-2-[(4-nitrophenyl)thio]propanamide IUPAC Name: N-[(2-cyclopentyloxypyridin-3-yl)methyl]-2-(4-nitrophenyl)sulfanylpropanamide Traditional Name: N-[[2-(cyclopentoxy)-3-pyridyl]methyl]-2-[(4-nitrophenyl)thio]propionamide Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=C(N=CC=C1)OC2CCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=C(N=CC=C1)OC2CCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4S/c1-14(28-18-10-8-16(9-11-18)23(25)26)19(24)22-13-15-5-4-12-21-20(15)27-17-6-2-3-7-17/h4-5,8-12,14,17H,2-3,6-7,13H2,1H3,(H,22,24)