(Z)-N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (Z)-N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (Z)-N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (Z)-N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (Z)-N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (Z)-N-(6-acetamido-3-propargyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)acrylamide Formula: C21H16N4O4S MolecularWeight: 420.44114

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])S2)CC#C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)/C=C\C3=CC=C(C=C3)[N+](=O)[O-])S2)CC#C

InChI

InChI=1S/C21H16N4O4S/c1-3-12-24-18-10-7-16(22-14(2)26)13-19(18)30-21(24)23-20(27)11-6-15-4-8-17(9-5-15)25(28)29/h1,4-11,13H,12H2,2H3,(H,22,26)/b11-6-,23-21?