N-cyclohexyl-2-[2-methylpropyl(quinolin-8-ylsulfonyl)amino]-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[2-methylpropyl(quinolin-8-ylsulfonyl)amino]-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]ethanamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-[isobutyl(8-quinolylsulfonyl)amino]acetamide CAS Name: N-cyclohexyl-2-[2-methylpropyl(8-quinolinylsulfonyl)amino]-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]acetamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-[2-methylpropyl(quinolin-8-ylsulfonyl)amino]acetamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-cyclohexyl-2-[isobutyl(8-quinolylsulfonyl)amino]acetamide Formula: C33H40N4O3S MolecularWeight: 572.7607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C33H40N4O3S/c1-26(2)22-36(41(39,40)31-19-9-14-28-15-10-20-34-33(28)31)25-32(38)37(29-16-7-4-8-17-29)24-30-18-11-21-35(30)23-27-12-5-3-6-13-27/h3,5-6,9-15,18-21,26,29H,4,7-8,16-17,22-25H2,1-2H3