[4-(phenylmethyl)piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: (4-benzylpiperazin-1-yl)-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: (4-benzylpiperazino)-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C17H19N3OS/c21-17(15-7-4-8-18-16(15)22)20-11-9-19(10-12-20)13-14-5-2-1-3-6-14/h1-8H,9-13H2,(H,18,22)