N-(3-chloranyl-4-piperazin-1-ylcarbonyl-phenyl)-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(3-chloranyl-4-piperazin-1-ylcarbonyl-phenyl)-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[3-chloro-4-(piperazine-1-carbonyl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[3-chloro-4-[oxo(1-piperazinyl)methyl]phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[3-chloro-4-(piperazine-1-carbonyl)phenyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[3-chloro-4-(piperazine-1-carbonyl)phenyl]-2-(phenylthio)nicotinamide Formula: C23H21ClN4O2S MolecularWeight: 452.95644

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C2=C(C=C(C=C2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN4O2S/c24-20-15-16(8-9-18(20)23(30)28-13-11-25-12-14-28)27-21(29)19-7-4-10-26-22(19)31-17-5-2-1-3-6-17/h1-10,15,25H,11-14H2,(H,27,29)