ethyl 3-cyclopropyl-4-[3-(2-methanethioylphenoxy)carbonylbut-3-en-2-ylideneamino]-2-methoxy-benzoate

Systemtic Name: ethyl 3-cyclopropyl-4-[3-(2-methanethioylphenoxy)carbonylbut-3-en-2-ylideneamino]-2-methoxy-benzoate Openeye Name: ethyl 3-cyclopropyl-4-[[2-(2-methanethioylphenoxy)carbonyl-1-methyl-prop-2-enylidene]amino]-2-methoxy-benzoate CAS Name: 3-cyclopropyl-4-[3-[(2-methanethioylphenoxy)-oxomethyl]but-3-en-2-ylideneamino]-2-methoxybenzoic acid ethyl ester IUPAC Name: ethyl 3-cyclopropyl-4-[3-(2-methanethioylphenoxy)carbonylbut-3-en-2-ylideneamino]-2-methoxybenzoate Traditional Name: 3-cyclopropyl-2-methoxy-4-[[1-methyl-2-(2-thioformylphenoxy)carbonyl-prop-2-enylidene]amino]benzoic acid ethyl ester Formula: C25H25NO5S MolecularWeight: 451.5347

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1)N=C(C)C(=C)C(=O)OC2=CC=CC=C2C=S)C3CC3)OC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1)N=C(C)C(=C)C(=O)OC2=CC=CC=C2C=S)C3CC3)OC

InChI

InChI=1S/C25H25NO5S/c1-5-30-25(28)19-12-13-20(22(17-10-11-17)23(19)29-4)26-16(3)15(2)24(27)31-21-9-7-6-8-18(21)14-32/h6-9,12-14,17H,2,5,10-11H2,1,3-4H3