N-[2-[3-[4-(phenylmethyl)piperazin-1-yl]propylcarbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[4-(phenylmethyl)piperazin-1-yl]propylcarbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-(4-benzylpiperazin-1-yl)propylcarbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[oxo-[3-[4-(phenylmethyl)-1-piperazinyl]propylamino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-(4-benzylpiperazin-1-yl)propylcarbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-(4-benzylpiperazino)propylcarbamoyl]phenyl]thiophene-2-carboxamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)C2=CC=CC=C2NC(=O)C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S/c31-25(22-10-4-5-11-23(22)28-26(32)24-12-6-19-33-24)27-13-7-14-29-15-17-30(18-16-29)20-21-8-2-1-3-9-21/h1-6,8-12,19H,7,13-18,20H2,(H,27,31)(H,28,32)