N-butan-2-yl-3-cyclopentyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]propanamide

Systemtic Name: N-butan-2-yl-3-cyclopentyl-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]propanamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-3-cyclopentyl-N-sec-butyl-propanamide CAS Name: N-butan-2-yl-3-cyclopentyl-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]propanamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-butan-2-yl-3-cyclopentylpropanamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-3-cyclopentyl-N-sec-butyl-propionamide Formula: C27H39N3O2 MolecularWeight: 437.61746

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)CCC3CCCC3

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)CCC3CCCC3

InChI

InChI=1S/C27H39N3O2/c1-4-22(2)30(26(31)17-16-23-11-8-9-12-23)21-27(32)29(19-24-13-6-5-7-14-24)20-25-15-10-18-28(25)3/h5-7,10,13-15,18,22-23H,4,8-9,11-12,16-17,19-21H2,1-3H3