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

Systemtic Name: N-[5-chloranyl-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-chloro-2-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[5-chloro-2-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-chloro-2-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[5-chloro-2-[4-(4-cyanobenzyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C24H21ClN4O2S MolecularWeight: 464.96714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN4O2S/c25-19-7-8-20(21(14-19)27-23(30)22-2-1-13-32-22)24(31)29-11-9-28(10-12-29)16-18-5-3-17(15-26)4-6-18/h1-8,13-14H,9-12,16H2,(H,27,30)