(2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)propanamide

Systemtic Name: (2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)propanamide Openeye Name: (2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)propanamide CAS Name: (2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylthio)propanamide IUPAC Name: (2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylsulfanyl)propanamide Traditional Name: (2R)-N-(2-nitrophenyl)-2-(1H-perimidin-2-ylthio)propionamide Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C20H16N4O3S/c1-12(19(25)21-14-8-2-3-11-17(14)24(26)27)28-20-22-15-9-4-6-13-7-5-10-16(23-20)18(13)15/h2-12H,1H3,(H,21,25)(H,22,23)/t12-/m1/s1