(4-chloranyl-1H-pyrrol-2-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-1H-pyrrol-2-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(4-chloro-1H-pyrrol-2-yl)methanone CAS Name: (4-chloro-1H-pyrrol-2-yl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(4-chloro-1H-pyrrol-2-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(4-chloro-1H-pyrrol-2-yl)methanone Formula: C16H18ClN3O3S MolecularWeight: 367.85042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CN2)Cl)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CN2)Cl)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H18ClN3O3S/c17-14-10-15(18-11-14)16(21)19-6-8-20(9-7-19)24(22,23)12-13-4-2-1-3-5-13/h1-5,10-11,18H,6-9,12H2