N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C23H19N3O4S2 MolecularWeight: 465.54466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O4S2/c1-30-20-11-10-15(12-19(20)26(28)29)13-31-14-22(27)24-17-7-3-2-6-16(17)23-25-18-8-4-5-9-21(18)32-23/h2-12H,13-14H2,1H3,(H,24,27)