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

Systemtic Name: N-butan-2-yl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-pentyl-benzamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-4-pentyl-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-4-pentylbenzamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-butan-2-yl-4-pentylbenzamide Traditional Name: 4-amyl-N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-sec-butyl-benzamide Formula: C31H41N3O2 MolecularWeight: 487.67614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CN3C)C(C)CC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CN3C)C(C)CC

InChI

InChI=1S/C31H41N3O2/c1-5-7-9-13-26-17-19-28(20-18-26)31(36)34(25(3)6-2)24-30(35)33(22-27-14-10-8-11-15-27)23-29-16-12-21-32(29)4/h8,10-12,14-21,25H,5-7,9,13,22-24H2,1-4H3