N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-ethyl-4-hexyl-benzamide

Systemtic Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-ethyl-4-hexyl-benzamide Openeye Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-ethyl-4-hexyl-benzamide CAS Name: N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-N-ethyl-4-hexylbenzamide IUPAC Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-N-ethyl-4-hexylbenzamide Traditional Name: N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-ethyl-4-hexyl-benzamide Formula: C35H46ClN3O2 MolecularWeight: 576.21164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC)CC(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC)CC(=O)N(CC2=CC=CN2CC3=CC=CC=C3Cl)C4CCCCC4

InChI

InChI=1S/C35H46ClN3O2/c1-3-5-6-8-14-28-20-22-29(23-21-28)35(41)37(4-2)27-34(40)39(31-16-9-7-10-17-31)26-32-18-13-24-38(32)25-30-15-11-12-19-33(30)36/h11-13,15,18-24,31H,3-10,14,16-17,25-27H2,1-2H3