1-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea

Systemtic Name: 1-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-3-phenyl-urea Openeye Name: 1-[3-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-oxo-propyl]-3-phenyl-urea CAS Name: 1-[3-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-3-phenylurea IUPAC Name: 1-[3-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-oxopropyl]-3-phenylurea Traditional Name: 1-[3-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-keto-propyl]-3-phenyl-urea Formula: C21H25ClN4O2 MolecularWeight: 400.9018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H25ClN4O2/c1-16-7-8-17(22)15-19(16)25-11-13-26(14-12-25)20(27)9-10-23-21(28)24-18-5-3-2-4-6-18/h2-8,15H,9-14H2,1H3,(H2,23,24,28)