N-[6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[6-[4-(2,4-dichlorophenyl)carbonylpiperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Openeye Name: N-[6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]-3-pyridyl]thiophene-2-carboxamide CAS Name: N-[6-[4-[(2,4-dichlorophenyl)-oxomethyl]-1-piperazinyl]-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: N-[6-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyridin-3-yl]thiophene-2-carboxamide Traditional Name: N-[6-[4-(2,4-dichlorobenzoyl)piperazino]-3-pyridyl]thiophene-2-carboxamide Formula: C21H18Cl2N4O2S MolecularWeight: 461.36422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC=CS3)C(=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)NC(=O)C3=CC=CS3)C(=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C21H18Cl2N4O2S/c22-14-3-5-16(17(23)12-14)21(29)27-9-7-26(8-10-27)19-6-4-15(13-24-19)25-20(28)18-2-1-11-30-18/h1-6,11-13H,7-10H2,(H,25,28)