3-butyl-2-[1-(phenylsulfonyl)pyrrol-2-yl]-1,3-thiazinan-4-one

Systemtic Name: 3-butyl-2-[1-(phenylsulfonyl)pyrrol-2-yl]-1,3-thiazinan-4-one Openeye Name: 2-[1-(benzenesulfonyl)pyrrol-2-yl]-3-butyl-1,3-thiazinan-4-one CAS Name: 2-[1-(benzenesulfonyl)-2-pyrrolyl]-3-butyl-1,3-thiazinan-4-one IUPAC Name: 2-[1-(benzenesulfonyl)pyrrol-2-yl]-3-butyl-1,3-thiazinan-4-one Traditional Name: 2-(1-besylpyrrol-2-yl)-3-butyl-1,3-thiazinan-4-one Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(SCCC1=O)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN1C(SCCC1=O)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H22N2O3S2/c1-2-3-12-19-17(21)11-14-24-18(19)16-10-7-13-20(16)25(22,23)15-8-5-4-6-9-15/h4-10,13,18H,2-3,11-12,14H2,1H3