methyl 5-(3,4-dihydro-2H-thiochromen-4-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(3,4-dihydro-2H-thiochromen-4-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-ethyl-4-methyl-5-(thiochroman-4-ylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 5-[(3,4-dihydro-2H-1-benzothiopyran-4-ylamino)-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(3,4-dihydro-2H-thiochromen-4-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 2-ethyl-4-methyl-5-(thiochroman-4-ylcarbamoyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2CCSC3=CC=CC=C23)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2CCSC3=CC=CC=C23)C)C(=O)OC

InChI

InChI=1S/C19H22N2O3S/c1-4-13-16(19(23)24-3)11(2)17(20-13)18(22)21-14-9-10-25-15-8-6-5-7-12(14)15/h5-8,14,20H,4,9-10H2,1-3H3,(H,21,22)