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

Systemtic Name: N-[2-[cyclohexyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-N-propan-2-yl-butanamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-isopropyl-butanamide CAS Name: N-[2-[cyclohexyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-N-propan-2-ylbutanamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexylamino]-2-oxoethyl]-N-propan-2-ylbutanamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]-2-keto-ethyl]-N-isopropyl-butyramide Formula: C27H39N3O2 MolecularWeight: 437.61746

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(C)C

Isomeric SMILES

CCCC(=O)N(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(C)C

InChI

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