N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]hexanamide

Systemtic Name: N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]hexanamide Openeye Name: N-[2-[benzyl-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]amino]-2-oxo-ethyl]-N-cyclopropyl-hexanamide CAS Name: N-cyclopropyl-N-[2-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl-(phenylmethyl)amino]-2-oxoethyl]hexanamide IUPAC Name: N-[2-[benzyl-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]amino]-2-oxoethyl]-N-cyclopropylhexanamide Traditional Name: N-[2-[benzyl-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]amino]-2-keto-ethyl]-N-cyclopropyl-hexanamide Formula: C31H39N3O2 MolecularWeight: 485.66026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C)C4CC4

Isomeric SMILES

CCCCCC(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2CC3=CC=CC=C3C)C4CC4

InChI

InChI=1S/C31H39N3O2/c1-3-4-6-17-30(35)34(28-18-19-28)24-31(36)33(21-26-13-7-5-8-14-26)23-29-16-11-20-32(29)22-27-15-10-9-12-25(27)2/h5,7-16,20,28H,3-4,6,17-19,21-24H2,1-2H3