(E)-N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-yl)-N-isobutyl-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-yl)-N-(2-methylpropyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-yl)-N-isobutyl-3-(3-nitrophenyl)acrylamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN(C1=NC2=CC=CC=C2S1)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S/c1-14(2)13-22(20-21-17-8-3-4-9-18(17)27-20)19(24)11-10-15-6-5-7-16(12-15)23(25)26/h3-12,14H,13H2,1-2H3/b11-10+