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

Systemtic Name: 2-[(2-bromophenyl)carbonylamino]-N-(pyridin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[(2-bromobenzoyl)amino]-N-(3-pyridylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[(2-bromobenzoyl)amino]-N-(pyridin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-[(2-bromobenzoyl)amino]-N-(3-pyridylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1CC2=C(C1)SC(=C2C(=O)NCC3=CN=CC=C3)NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C21H18BrN3O2S/c22-16-8-2-1-6-14(16)19(26)25-21-18(15-7-3-9-17(15)28-21)20(27)24-12-13-5-4-10-23-11-13/h1-2,4-6,8,10-11H,3,7,9,12H2,(H,24,27)(H,25,26)