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

Systemtic Name: 3-(2-chloranyl-6-methyl-phenyl)-1-(2-diethylaminoethyl)-1-(phenylmethyl)urea hydrochloride Openeye Name: 1-benzyl-3-(2-chloro-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride CAS Name: 3-(2-chloro-6-methylphenyl)-1-(2-diethylaminoethyl)-1-(phenylmethyl)urea hydrochloride IUPAC Name: 1-benzyl-3-(2-chloro-6-methylphenyl)-1-(2-diethylaminoethyl)urea hydrochloride Traditional Name: 1-benzyl-3-(2-chloro-6-methyl-phenyl)-1-(2-diethylaminoethyl)urea hydrochloride Formula: C21H29Cl2N3O MolecularWeight: 410.38046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(CC1=CC=CC=C1)C(=O)NC2=C(C=CC=C2Cl)C.Cl

Isomeric SMILES

CCN(CC)CCN(CC1=CC=CC=C1)C(=O)NC2=C(C=CC=C2Cl)C.Cl

InChI

InChI=1S/C21H28ClN3O.ClH/c1-4-24(5-2)14-15-25(16-18-11-7-6-8-12-18)21(26)23-20-17(3)10-9-13-19(20)22;/h6-13H,4-5,14-16H2,1-3H3,(H,23,26);1H