1,3-bis(2-chloranyl-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride

Systemtic Name: 1,3-bis(2-chloranyl-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride Openeye Name: 1,3-bis(2-chloro-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride CAS Name: 1,3-bis(2-chloro-6-methylphenyl)-1-(2-diethylaminoethyl)urea hydrochloride IUPAC Name: 1,3-bis(2-chloro-6-methylphenyl)-1-(2-diethylaminoethyl)urea hydrochloride Traditional Name: 1,3-bis(2-chloro-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride Formula: C21H28Cl3N3O MolecularWeight: 444.82552

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=C(C=CC=C1Cl)C)C(=O)NC2=C(C=CC=C2Cl)C.Cl

Isomeric SMILES

CCN(CC)CCN(C1=C(C=CC=C1Cl)C)C(=O)NC2=C(C=CC=C2Cl)C.Cl

InChI

InChI=1S/C21H27Cl2N3O.ClH/c1-5-25(6-2)13-14-26(20-16(4)10-8-12-18(20)23)21(27)24-19-15(3)9-7-11-17(19)22;/h7-12H,5-6,13-14H2,1-4H3,(H,24,27);1H