methyl 2-[(2-pyridin-3-yl-1H-indol-3-yl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(2-pyridin-3-yl-1H-indol-3-yl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3-pyridyl)-1H-indol-3-yl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[oxo-[[2-(3-pyridinyl)-1H-indol-3-yl]amino]methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-pyridin-3-yl-1H-indol-3-yl)carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(3-pyridyl)-1H-indol-3-yl]carbamoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC3=C(NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)NC3=C(NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C24H22N4O3S/c1-31-23(29)19-16-9-3-5-11-18(16)32-22(19)28-24(30)27-21-15-8-2-4-10-17(15)26-20(21)14-7-6-12-25-13-14/h2,4,6-8,10,12-13,26H,3,5,9,11H2,1H3,(H2,27,28,30)