N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-(3-ethoxypropyl)-4-methyl-benzamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-(3-ethoxypropyl)-4-methyl-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-N-(3-ethoxypropyl)-4-methyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-(3-ethoxypropyl)-4-methylbenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-(3-ethoxypropyl)-4-methylbenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-N-(3-ethoxypropyl)-4-methyl-benzamide Formula: C31H40BrN3O3 MolecularWeight: 582.5716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(CCCOCC)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(CCCOCC)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C31H40BrN3O3/c1-4-6-18-34(23-29-9-7-19-33(29)22-26-12-16-28(32)17-13-26)30(36)24-35(20-8-21-38-5-2)31(37)27-14-10-25(3)11-15-27/h7,9-17,19H,4-6,8,18,20-24H2,1-3H3