N-(4-bromophenyl)-2-[3-(pyridin-2-ylmethylamino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: N-(4-bromophenyl)-2-[3-(pyridin-2-ylmethylamino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: N-(4-bromophenyl)-2-[3-(2-pyridylmethylamino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: N-(4-bromophenyl)-2-[[1-oxo-3-(2-pyridinylmethylamino)propyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: N-(4-bromophenyl)-2-[3-(pyridin-2-ylmethylamino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: N-(4-bromophenyl)-2-[3-(2-pyridylmethylamino)propanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C23H23BrN4O2S MolecularWeight: 499.42332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Br)NC(=O)CCNCC4=CC=CC=N4

Isomeric SMILES

C1CC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)Br)NC(=O)CCNCC4=CC=CC=N4

InChI

InChI=1S/C23H23BrN4O2S/c24-15-7-9-16(10-8-15)27-22(30)21-18-5-3-6-19(18)31-23(21)28-20(29)11-13-25-14-17-4-1-2-12-26-17/h1-2,4,7-10,12,25H,3,5-6,11,13-14H2,(H,27,30)(H,28,29)