methyl 2-[(2-azanylidene-8-ethoxy-chromen-3-yl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-azanylidene-8-ethoxy-chromen-3-yl)carbonylamino]-5-(phenylmethyl)thiophene-3-carboxylate Openeye Name: methyl 5-benzyl-2-[(8-ethoxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 2-[[(8-ethoxy-2-imino-1-benzopyran-3-yl)-oxomethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-2-[(8-ethoxy-2-iminochromene-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 5-benzyl-2-[(8-ethoxy-2-imino-chromene-3-carbonyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=N)C(=C2)C(=O)NC3=C(C=C(S3)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=N)C(=C2)C(=O)NC3=C(C=C(S3)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H22N2O5S/c1-3-31-20-11-7-10-16-13-18(22(26)32-21(16)20)23(28)27-24-19(25(29)30-2)14-17(33-24)12-15-8-5-4-6-9-15/h4-11,13-14,26H,3,12H2,1-2H3,(H,27,28)