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

Systemtic Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-ethylphenyl)urea Openeye Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-ethylphenyl)urea CAS Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-3-pyrrolyl]methyl]-3-(4-ethylphenyl)urea IUPAC Name: 1-[[1-(3-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methyl]-3-(4-ethylphenyl)urea Traditional Name: 1-[[1-(3-chlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyl]-3-(4-ethylphenyl)urea Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NCC2=C(N(C(=C2)C)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C22H24ClN3O/c1-4-17-8-10-20(11-9-17)25-22(27)24-14-18-12-15(2)26(16(18)3)21-7-5-6-19(23)13-21/h5-13H,4,14H2,1-3H3,(H2,24,25,27)