4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)ethanoyl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[2-(4H-3,1-benzothiazin-2-ylthio)-1-oxoethyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[2-(4H-3,1-benzothiazin-2-ylsulfanyl)acetyl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[2-(4H-3,1-benzothiazin-2-ylthio)acetyl]-N-phenyl-piperazine-1-carboxamide Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3CS2)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC3=CC=CC=C3CS2)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2S2/c26-19(15-29-21-23-18-9-5-4-6-16(18)14-28-21)24-10-12-25(13-11-24)20(27)22-17-7-2-1-3-8-17/h1-9H,10-15H2,(H,22,27)