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

Systemtic Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-hexyl-N-propan-2-yl-benzamide Openeye Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-4-hexyl-N-isopropyl-benzamide CAS Name: N-[2-[butyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-4-hexyl-N-propan-2-ylbenzamide IUPAC Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-hexyl-N-propan-2-ylbenzamide Traditional Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-4-hexyl-N-isopropyl-benzamide Formula: C28H43N3O2 MolecularWeight: 453.65992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CCCC)CC2=CC=CN2C)C(C)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CCCC)CC2=CC=CN2C)C(C)C

InChI

InChI=1S/C28H43N3O2/c1-6-8-10-11-13-24-15-17-25(18-16-24)28(33)31(23(3)4)22-27(32)30(20-9-7-2)21-26-14-12-19-29(26)5/h12,14-19,23H,6-11,13,20-22H2,1-5H3