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

Systemtic Name: 1-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea CAS Name: 1-[[6-ethyl-2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl]methyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea Traditional Name: 1-benzyl-3-[(6-ethyl-2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-3-yl)methyl]urea Formula: C22H26N4OS MolecularWeight: 394.53304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C1)SC(=C2CNC(=O)NCC3=CC=CC=C3)N4C=CC=C4

Isomeric SMILES

CCN1CCC2=C(C1)SC(=C2CNC(=O)NCC3=CC=CC=C3)N4C=CC=C4

InChI

InChI=1S/C22H26N4OS/c1-2-25-13-10-18-19(21(28-20(18)16-25)26-11-6-7-12-26)15-24-22(27)23-14-17-8-4-3-5-9-17/h3-9,11-12H,2,10,13-16H2,1H3,(H2,23,24,27)