(E)-N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(5,6-dimethyl-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3-allyl-5,6-dimethyl-1,3-benzothiazol-2-ylidene)-3-(3-nitrophenyl)acrylamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-])N2CC=C

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-])N2CC=C

InChI

InChI=1S/C21H19N3O3S/c1-4-10-23-18-11-14(2)15(3)12-19(18)28-21(23)22-20(25)9-8-16-6-5-7-17(13-16)24(26)27/h4-9,11-13H,1,10H2,2-3H3/b9-8+,22-21?