N-(2-nitrophenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-nitrophenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-propanamide Openeye Name: N-(2-nitrophenyl)-2-[5-phenyl-1-(tetrahydrofuran-2-ylmethyl)imidazol-2-yl]sulfanyl-propanamide CAS Name: N-(2-nitrophenyl)-2-[[1-(2-oxolanylmethyl)-5-phenyl-2-imidazolyl]thio]propanamide IUPAC Name: N-(2-nitrophenyl)-2-[1-(oxolan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylpropanamide Traditional Name: N-(2-nitrophenyl)-2-[[5-phenyl-1-(tetrahydrofurfuryl)imidazol-2-yl]thio]propionamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O4S/c1-16(22(28)25-19-11-5-6-12-20(19)27(29)30)32-23-24-14-21(17-8-3-2-4-9-17)26(23)15-18-10-7-13-31-18/h2-6,8-9,11-12,14,16,18H,7,10,13,15H2,1H3,(H,25,28)