1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(phenylmethyl)urea

Systemtic Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-cyclohexyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 3-benzyl-1-cyclohexyl-1-[(1-m-anisylpyrrol-2-yl)methyl]urea Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=CC=C2CN(C3CCCCC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2/c1-32-26-16-8-12-23(18-26)20-29-17-9-15-25(29)21-30(24-13-6-3-7-14-24)27(31)28-19-22-10-4-2-5-11-22/h2,4-5,8-12,15-18,24H,3,6-7,13-14,19-21H2,1H3,(H,28,31)