1-butan-2-yl-3-(3-cyanophenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 1-butan-2-yl-3-(3-cyanophenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3-cyanophenyl)-1-sec-butyl-urea CAS Name: 1-butan-2-yl-3-(3-cyanophenyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-butan-2-yl-3-(3-cyanophenyl)urea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-3-(3-cyanophenyl)-1-sec-butyl-urea Formula: C24H26N4O MolecularWeight: 386.48944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CCC(C)N(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H26N4O/c1-3-19(2)28(24(29)26-22-12-7-11-21(15-22)16-25)18-23-13-8-14-27(23)17-20-9-5-4-6-10-20/h4-15,19H,3,17-18H2,1-2H3,(H,26,29)