(E)-N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)acrylamide Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])N2CC#C

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])N2CC#C

InChI

InChI=1S/C20H15N3O4S/c1-3-12-22-19-16(27-2)8-5-9-17(19)28-20(22)21-18(24)11-10-14-6-4-7-15(13-14)23(25)26/h1,4-11,13H,12H2,2H3/b11-10+,21-20?