methyl 3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate

Systemtic Name: methyl 3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate Openeye Name: methyl 3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate CAS Name: 3-[[[[6-methyl-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]methylamino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate Traditional Name: 3-[(6-methyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoic acid methyl ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)SC(=C2CNC(=O)NC3=CC=CC(=C3)C(=O)OC)N4C=CC=C4

Isomeric SMILES

CN1CCC2=C(C1)SC(=C2CNC(=O)NC3=CC=CC(=C3)C(=O)OC)N4C=CC=C4

InChI

InChI=1S/C22H24N4O3S/c1-25-11-8-17-18(20(30-19(17)14-25)26-9-3-4-10-26)13-23-22(28)24-16-7-5-6-15(12-16)21(27)29-2/h3-7,9-10,12H,8,11,13-14H2,1-2H3,(H2,23,24,28)