1-(4-chlorophenyl)-3-[[4,5-dimethyl-1-(phenylmethyl)-2-pyrrol-1-yl-pyrrol-3-yl]methyl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[[4,5-dimethyl-1-(phenylmethyl)-2-pyrrol-1-yl-pyrrol-3-yl]methyl]urea Openeye Name: 1-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-yl-pyrrol-3-yl)methyl]-3-(4-chlorophenyl)urea CAS Name: 1-(4-chlorophenyl)-3-[[4,5-dimethyl-1-(phenylmethyl)-2-(1-pyrrolyl)-3-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-ylpyrrol-3-yl)methyl]-3-(4-chlorophenyl)urea Traditional Name: 1-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-yl-pyrrol-3-yl)methyl]-3-(4-chlorophenyl)urea Formula: C25H25ClN4O MolecularWeight: 432.9452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1CNC(=O)NC2=CC=C(C=C2)Cl)N3C=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C(=C1CNC(=O)NC2=CC=C(C=C2)Cl)N3C=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H25ClN4O/c1-18-19(2)30(17-20-8-4-3-5-9-20)24(29-14-6-7-15-29)23(18)16-27-25(31)28-22-12-10-21(26)11-13-22/h3-15H,16-17H2,1-2H3,(H2,27,28,31)