2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-fluorophenyl)sulfonyl-prop-2-enyl-amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[allyl-(4-fluorophenyl)sulfonyl-amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]-N-[(1-methyl-2-pyrrolyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-fluorophenyl)sulfonyl-prop-2-enylamino]-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[allyl-(4-fluorophenyl)sulfonyl-amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C24H26FN3O3S MolecularWeight: 455.544943

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(CC=C)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H26FN3O3S/c1-3-15-28(32(30,31)23-13-11-21(25)12-14-23)19-24(29)27(17-20-8-5-4-6-9-20)18-22-10-7-16-26(22)2/h3-14,16H,1,15,17-19H2,2H3