N-[2-[cyclohexyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-2-fluoranyl-N-(3-methoxypropyl)benzamide

Systemtic Name: N-[2-[cyclohexyl-[[1-(phenylmethyl)pyrrol-2-yl]methyl]amino]-2-oxidanylidene-ethyl]-2-fluoranyl-N-(3-methoxypropyl)benzamide Openeye Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]-2-oxo-ethyl]-2-fluoro-N-(3-methoxypropyl)benzamide CAS Name: N-[2-[cyclohexyl-[[1-(phenylmethyl)-2-pyrrolyl]methyl]amino]-2-oxoethyl]-2-fluoro-N-(3-methoxypropyl)benzamide IUPAC Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexylamino]-2-oxoethyl]-2-fluoro-N-(3-methoxypropyl)benzamide Traditional Name: N-[2-[(1-benzylpyrrol-2-yl)methyl-cyclohexyl-amino]-2-keto-ethyl]-2-fluoro-N-(3-methoxypropyl)benzamide Formula: C31H38FN3O3 MolecularWeight: 519.650123

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

COCCCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2)C3CCCCC3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C31H38FN3O3/c1-38-21-11-20-34(31(37)28-17-8-9-18-29(28)32)24-30(36)35(26-14-6-3-7-15-26)23-27-16-10-19-33(27)22-25-12-4-2-5-13-25/h2,4-5,8-10,12-13,16-19,26H,3,6-7,11,14-15,20-24H2,1H3