[5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] benzoate

Systemtic Name: [5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxidanylidene-cyclohexen-1-yl] benzoate Openeye Name: [5-(4,5-dimethylthiazol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-oxo-cyclohexen-1-yl] benzoate CAS Name: benzoic acid [5-(4,5-dimethyl-2-thiazolyl)-2-[(1Z)-1-ethoxyiminobutyl]-3-oxo-1-cyclohexenyl] ester IUPAC Name: [5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(Z)-N-ethoxy-C-propylcarbonimidoyl]-3-oxocyclohexen-1-yl] benzoate Traditional Name: benzoic acid [5-(4,5-dimethylthiazol-2-yl)-2-[(Z)-N-ethoxy-C-propyl-carbonimidoyl]-3-keto-cyclohexen-1-yl] ester Formula: C24H28N2O4S MolecularWeight: 440.55512

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NOCC)C1=C(CC(CC1=O)C2=NC(=C(S2)C)C)OC(=O)C3=CC=CC=C3

Isomeric SMILES

CCC/C(=N/OCC)/C1=C(CC(CC1=O)C2=NC(=C(S2)C)C)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H28N2O4S/c1-5-10-19(26-29-6-2)22-20(27)13-18(23-25-15(3)16(4)31-23)14-21(22)30-24(28)17-11-8-7-9-12-17/h7-9,11-12,18H,5-6,10,13-14H2,1-4H3/b26-19-