1-(3,4-dimethylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methyl-1-piperazinyl)-2-(1-methyl-2-pyrrolyl)ethyl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[2-(4-methylpiperazino)-2-(1-methylpyrrol-2-yl)ethyl]urea Formula: C21H31N5O MolecularWeight: 369.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCC(C2=CC=CN2C)N3CCN(CC3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCC(C2=CC=CN2C)N3CCN(CC3)C)C

InChI

InChI=1S/C21H31N5O/c1-16-7-8-18(14-17(16)2)23-21(27)22-15-20(19-6-5-9-25(19)4)26-12-10-24(3)11-13-26/h5-9,14,20H,10-13,15H2,1-4H3,(H2,22,23,27)