1-[(5S)-4-azanyl-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]prop-2-en-1-one

Systemtic Name: 1-[(5S)-4-azanyl-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]prop-2-en-1-one Openeye Name: 1-[(5S)-4-amino-5-methyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]prop-2-en-1-one CAS Name: 1-[(5S)-4-amino-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]-2-propen-1-one IUPAC Name: 1-[(5S)-4-amino-5-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]prop-2-en-1-one Traditional Name: 1-[(5S)-4-amino-5-methyl-1-tosyl-3-pyrrolin-3-yl]prop-2-en-1-one Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=C(CN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)C=C)N

Isomeric SMILES

C[C@H]1C(=C(CN1S(=O)(=O)C2=CC=C(C=C2)C)C(=O)C=C)N

InChI

InChI=1S/C15H18N2O3S/c1-4-14(18)13-9-17(11(3)15(13)16)21(19,20)12-7-5-10(2)6-8-12/h4-8,11H,1,9,16H2,2-3H3/t11-/m0/s1