N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-[2-methylpropyl-[(E)-2-phenylethenyl]sulfonyl-amino]-N-(phenylmethyl)ethanamide

Systemtic Name: N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-[2-methylpropyl-[(E)-2-phenylethenyl]sulfonyl-amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-[isobutyl-[(E)-styryl]sulfonyl-amino]acetamide CAS Name: N-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-2-[2-methylpropyl-[(E)-2-phenylethenyl]sulfonylamino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-[2-methylpropyl-[(E)-2-phenylethenyl]sulfonylamino]acetamide Traditional Name: N-benzyl-N-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]-2-[isobutyl-[(E)-styryl]sulfonyl-amino]acetamide Formula: C33H36FN3O3S MolecularWeight: 573.720643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=C(C=C3)F)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=C(C=C3)F)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C33H36FN3O3S/c1-27(2)22-37(41(39,40)21-19-28-10-5-3-6-11-28)26-33(38)36(24-29-12-7-4-8-13-29)25-32-14-9-20-35(32)23-30-15-17-31(34)18-16-30/h3-21,27H,22-26H2,1-2H3/b21-19+