N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-butan-2-yl-3,5-dimethoxy-benzamide

Systemtic Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxidanylidene-ethyl]-N-butan-2-yl-3,5-dimethoxy-benzamide Openeye Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butyl-amino]-2-oxo-ethyl]-3,5-dimethoxy-N-sec-butyl-benzamide CAS Name: N-[2-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl-butylamino]-2-oxoethyl]-N-butan-2-yl-3,5-dimethoxybenzamide IUPAC Name: N-[2-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl-butylamino]-2-oxoethyl]-N-butan-2-yl-3,5-dimethoxybenzamide Traditional Name: N-[2-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl-butyl-amino]-2-keto-ethyl]-3,5-dimethoxy-N-sec-butyl-benzamide Formula: C31H40BrN3O4 MolecularWeight: 598.571

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H40BrN3O4/c1-6-8-15-34(21-27-10-9-16-33(27)20-24-11-13-26(32)14-12-24)30(36)22-35(23(3)7-2)31(37)25-17-28(38-4)19-29(18-25)39-5/h9-14,16-19,23H,6-8,15,20-22H2,1-5H3