N-[2-[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[oxo-[4-[4-(phenylmethyl)-1-piperazinyl]anilino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[[4-(4-benzylpiperazin-1-yl)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[[4-(4-benzylpiperazino)phenyl]carbamoyl]phenyl]thiophene-2-carboxamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4NC(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4NC(=O)C5=CC=CS5

InChI

InChI=1S/C29H28N4O2S/c34-28(25-9-4-5-10-26(25)31-29(35)27-11-6-20-36-27)30-23-12-14-24(15-13-23)33-18-16-32(17-19-33)21-22-7-2-1-3-8-22/h1-15,20H,16-19,21H2,(H,30,34)(H,31,35)