(Z)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (Z)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (Z)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (Z)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (Z)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (Z)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-(4-nitrophenyl)acrylamide Formula: C17H13N3O3S2 MolecularWeight: 371.43342

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)NC(=O)/C=C\C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3S2/c1-24-13-3-2-4-14-16(13)19-17(25-14)18-15(21)10-7-11-5-8-12(9-6-11)20(22)23/h2-10H,1H3,(H,18,19,21)/b10-7-