N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-oxidanylidene-1-thiophen-2-yl-ethyl]pyrazine-2-carboxamide

Systemtic Name: N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-oxidanylidene-1-thiophen-2-yl-ethyl]pyrazine-2-carboxamide Openeye Name: N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-oxo-1-(2-thienyl)ethyl]pyrazine-2-carboxamide CAS Name: N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-2-pyrazinecarboxamide IUPAC Name: N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]pyrazine-2-carboxamide Traditional Name: N-(4-bromophenyl)-N-[2-(cyclopentylamino)-2-keto-1-(2-thienyl)ethyl]pyrazinamide Formula: C22H21BrN4O2S MolecularWeight: 485.39674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=CS2)N(C3=CC=C(C=C3)Br)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=CS2)N(C3=CC=C(C=C3)Br)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C22H21BrN4O2S/c23-15-7-9-17(10-8-15)27(22(29)18-14-24-11-12-25-18)20(19-6-3-13-30-19)21(28)26-16-4-1-2-5-16/h3,6-14,16,20H,1-2,4-5H2,(H,26,28)