(E)-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(3-allyl-6-methylsulfonyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3-allyl-6-mesyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)acrylamide Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O5S2/c1-3-11-22-17-9-8-16(30(2,27)28)13-18(17)29-20(22)21-19(24)10-7-14-5-4-6-15(12-14)23(25)26/h3-10,12-13H,1,11H2,2H3/b10-7+,21-20?