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

Systemtic Name: 3-[3-(diethylamino)propyl]-2-[1-(phenylsulfonyl)pyrrol-2-yl]-1,3-thiazinan-4-one Openeye Name: 2-[1-(benzenesulfonyl)pyrrol-2-yl]-3-[3-(diethylamino)propyl]-1,3-thiazinan-4-one CAS Name: 2-[1-(benzenesulfonyl)-2-pyrrolyl]-3-[3-(diethylamino)propyl]-1,3-thiazinan-4-one IUPAC Name: 2-[1-(benzenesulfonyl)pyrrol-2-yl]-3-[3-(diethylamino)propyl]-1,3-thiazinan-4-one Traditional Name: 2-(1-besylpyrrol-2-yl)-3-[3-(diethylamino)propyl]-1,3-thiazinan-4-one Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C(SCCC1=O)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCCN1C(SCCC1=O)C2=CC=CN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H29N3O3S2/c1-3-22(4-2)14-9-15-23-20(25)13-17-28-21(23)19-12-8-16-24(19)29(26,27)18-10-6-5-7-11-18/h5-8,10-12,16,21H,3-4,9,13-15,17H2,1-2H3