N-[2-chloranyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-(4-benzylpiperazine-1-carbonyl)-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-(4-benzylpiperazine-1-carbonyl)-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-(4-benzylpiperazine-1-carbonyl)-2-chloro-phenyl]thiophene-2-carboxamide Formula: C23H22ClN3O2S MolecularWeight: 439.95768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H22ClN3O2S/c24-19-9-8-18(15-20(19)25-22(28)21-7-4-14-30-21)23(29)27-12-10-26(11-13-27)16-17-5-2-1-3-6-17/h1-9,14-15H,10-13,16H2,(H,25,28)