(E)-3-(4-nitrophenyl)-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)prop-2-enamide

Systemtic Name: (E)-3-(4-nitrophenyl)-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)prop-2-enamide Openeye Name: (E)-N-(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-3-(4-nitrophenyl)-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)-2-propenamide IUPAC Name: (E)-3-(4-nitrophenyl)-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)prop-2-enamide Traditional Name: (E)-N-(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-(4-nitrophenyl)acrylamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N3O3S/c1-4-13-24-19-11-8-17(15(2)3)14-20(19)29-22(24)23-21(26)12-7-16-5-9-18(10-6-16)25(27)28/h5-12,14-15H,4,13H2,1-3H3/b12-7+,23-22?