1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-cyanophenyl)-1-propyl-urea

Systemtic Name: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-cyanophenyl)-1-propyl-urea Openeye Name: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-cyanophenyl)-1-propyl-urea CAS Name: 1-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-3-(3-cyanophenyl)-1-propylurea IUPAC Name: 1-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-cyanophenyl)-1-propylurea Traditional Name: 1-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-3-(3-cyanophenyl)-1-propyl-urea Formula: C23H23ClN4O MolecularWeight: 406.90792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN4O/c1-2-11-28(23(29)26-21-9-4-6-18(14-21)15-25)17-22-10-5-12-27(22)16-19-7-3-8-20(24)13-19/h3-10,12-14H,2,11,16-17H2,1H3,(H,26,29)