4-methylsulfonyl-6-propan-2-yl-1-[(E)-4-pyrrolidin-1-ylbut-2-enoyl]-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one

Systemtic Name: 4-methylsulfonyl-6-propan-2-yl-1-[(E)-4-pyrrolidin-1-ylbut-2-enoyl]-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one Openeye Name: 6-isopropyl-4-methylsulfonyl-1-[(E)-4-pyrrolidin-1-ylbut-2-enoyl]-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one CAS Name: 4-methylsulfonyl-1-[(E)-1-oxo-4-(1-pyrrolidinyl)but-2-enyl]-6-propan-2-yl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one IUPAC Name: 4-methylsulfonyl-6-propan-2-yl-1-[(E)-4-pyrrolidin-1-ylbut-2-enoyl]-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one Traditional Name: 6-isopropyl-4-mesyl-1-[(E)-4-pyrrolidinobut-2-enoyl]-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one Formula: C18H29N3O4S MolecularWeight: 383.50556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2C(CCN2C(=O)C=CCN3CCCC3)N(C1=O)S(=O)(=O)C

Isomeric SMILES

CC(C)C1C2C(CCN2C(=O)/C=C/CN3CCCC3)N(C1=O)S(=O)(=O)C

InChI

InChI=1S/C18H29N3O4S/c1-13(2)16-17-14(21(18(16)23)26(3,24)25)8-12-20(17)15(22)7-6-11-19-9-4-5-10-19/h6-7,13-14,16-17H,4-5,8-12H2,1-3H3/b7-6+