(2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)propanamide

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)propanamide Openeye Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)propanamide CAS Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-(4-nitrophenyl)propanamide IUPAC Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-(4-nitrophenyl)propanamide Traditional Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-(4-nitrophenyl)propionamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13N3O3S2/c1-10(23-16-18-13-4-2-3-5-14(13)24-16)15(20)17-11-6-8-12(9-7-11)19(21)22/h2-10H,1H3,(H,17,20)/t10-/m1/s1