[2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxidanylidene-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxo-ethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)pentylamino]-2-oxoethyl] (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid [2-[2-(2,4-dichlorophenyl)pentylamino]-2-keto-ethyl] ester Formula: C23H22Cl2N2O3S MolecularWeight: 477.40338

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNC(=O)COC(=O)C=CC1=NC2=CC=CC=C2S1)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCC(CNC(=O)COC(=O)/C=C/C1=NC2=CC=CC=C2S1)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H22Cl2N2O3S/c1-2-5-15(17-9-8-16(24)12-18(17)25)13-26-21(28)14-30-23(29)11-10-22-27-19-6-3-4-7-20(19)31-22/h3-4,6-12,15H,2,5,13-14H2,1H3,(H,26,28)/b11-10+