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

Systemtic Name: methyl 2-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate Openeye Name: methyl 2-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate CAS Name: 2-[[[[6-ethyl-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]methylamino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoate Traditional Name: 2-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methylcarbamoylamino]benzoic acid methyl ester Formula: C23H26N4O3S MolecularWeight: 438.54254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)SC(=C2CNC(=O)NC3=CC=CC=C3C(=O)OC)N4C=CC=C4

Isomeric SMILES

CCN1CCC2=C(C1)SC(=C2CNC(=O)NC3=CC=CC=C3C(=O)OC)N4C=CC=C4

InChI

InChI=1S/C23H26N4O3S/c1-3-26-13-10-16-18(21(31-20(16)15-26)27-11-6-7-12-27)14-24-23(29)25-19-9-5-4-8-17(19)22(28)30-2/h4-9,11-12H,3,10,13-15H2,1-2H3,(H2,24,25,29)