N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-4-pentyl-benzamide

Systemtic Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-4-pentyl-benzamide Openeye Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-4-pentyl-benzamide CAS Name: N-[2-[butyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-4-pentylbenzamide IUPAC Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-4-pentylbenzamide Traditional Name: 4-amyl-N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-isobutyl-benzamide Formula: C28H43N3O2 MolecularWeight: 453.65992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CCCC)CC2=CC=CN2C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CCCC)CC2=CC=CN2C

InChI

InChI=1S/C28H43N3O2/c1-6-8-10-12-24-14-16-25(17-15-24)28(33)31(20-23(3)4)22-27(32)30(19-9-7-2)21-26-13-11-18-29(26)5/h11,13-18,23H,6-10,12,19-22H2,1-5H3