5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)-3H-pyrrol-2-one

Systemtic Name: 5-azanyl-4-(1,3-benzothiazol-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)-3H-pyrrol-2-one Openeye Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-[3-(1-piperidylsulfonyl)phenyl]-3H-pyrrol-2-one CAS Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-[3-(1-piperidinylsulfonyl)phenyl]-3H-pyrrol-2-one IUPAC Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(3-piperidin-1-ylsulfonylphenyl)-3H-pyrrol-2-one Traditional Name: 5-amino-4-(1,3-benzothiazol-2-yl)-1-(3-piperidinosulfonylphenyl)-2-pyrrolin-2-one Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C(=O)CC(=C3N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)N3C(=O)CC(=C3N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H22N4O3S2/c23-21-17(22-24-18-9-2-3-10-19(18)30-22)14-20(27)26(21)15-7-6-8-16(13-15)31(28,29)25-11-4-1-5-12-25/h2-3,6-10,13H,1,4-5,11-12,14,23H2