N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)benzyl]-3-(3-nitrophenyl)acrylamide Formula: C23H17N3O3S MolecularWeight: 415.46438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)CNC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)CNC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O3S/c27-22(13-10-16-4-3-5-19(14-16)26(28)29)24-15-17-8-11-18(12-9-17)23-25-20-6-1-2-7-21(20)30-23/h1-14H,15H2,(H,24,27)