ethyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-azanylidene-8-oxidanyl-chromen-3-yl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(8-hydroxy-2-imino-1-benzopyran-3-yl)-oxomethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(8-hydroxy-2-iminochromene-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(8-hydroxy-2-imino-chromene-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC4=C(C(=CC=C4)O)OC3=N

InChI

InChI=1S/C22H22N2O5S/c1-3-28-22(27)17-13-8-7-11(2)9-16(13)30-21(17)24-20(26)14-10-12-5-4-6-15(25)18(12)29-19(14)23/h4-6,10-11,23,25H,3,7-9H2,1-2H3,(H,24,26)