N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enyl-amino]ethanamide

Systemtic Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl-[(E)-styryl]sulfonyl-amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: N-(2-methylpropyl)-N-[(1-methyl-2-pyrrolyl)methyl]-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enylamino]acetamide IUPAC Name: N-(2-methylpropyl)-N-[(1-methylpyrrol-2-yl)methyl]-2-[[(E)-2-phenylethenyl]sulfonyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[(E)-styryl]sulfonyl-amino]-N-isobutyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)CN(CC1=CC=CN1C)C(=O)CN(CC=C)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C23H31N3O3S/c1-5-14-26(30(28,29)16-13-21-10-7-6-8-11-21)19-23(27)25(17-20(2)3)18-22-12-9-15-24(22)4/h5-13,15-16,20H,1,14,17-19H2,2-4H3/b16-13+