N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-2-ethyl-butanamide

Systemtic Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-2-ethyl-butanamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-oxo-ethyl]-N-butyl-2-ethyl-butanamide CAS Name: N-butyl-N-[2-[cyclopropyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-2-ethylbutanamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropylamino]-2-oxoethyl]-N-butyl-2-ethylbutanamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclopropyl-amino]-2-keto-ethyl]-N-butyl-2-ethyl-butyramide Formula: C27H39N3O2 MolecularWeight: 437.61746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)C(CC)CC

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CC3)C(=O)C(CC)CC

InChI

InChI=1S/C27H39N3O2/c1-4-7-17-29(27(32)23(5-2)6-3)21-26(31)30(24-15-16-24)20-25-14-11-18-28(25)19-22-12-9-8-10-13-22/h8-14,18,23-24H,4-7,15-17,19-21H2,1-3H3