1-[4-[3-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]propoxy]phenyl]-3-methyl-urea hydrochloride

Systemtic Name: 1-[4-[3-[4-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazin-1-yl]propoxy]phenyl]-3-methyl-urea hydrochloride Openeye Name: 1-[4-[3-[4-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)piperazin-1-yl]propoxy]phenyl]-3-methyl-urea hydrochloride CAS Name: 1-[4-[3-[4-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-1-piperazinyl]propoxy]phenyl]-3-methylurea hydrochloride IUPAC Name: 1-[4-[3-[4-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)piperazin-1-yl]propoxy]phenyl]-3-methylurea hydrochloride Traditional Name: 1-[4-[3-[4-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)piperazino]propoxy]phenyl]-3-methyl-urea hydrochloride Formula: C21H31ClN6O4 MolecularWeight: 466.96164

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC=C(C=C1)OCCCN2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C.Cl

Isomeric SMILES

CNC(=O)NC1=CC=C(C=C1)OCCCN2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C.Cl

InChI

InChI=1S/C21H30N6O4.ClH/c1-22-20(29)23-16-5-7-17(8-6-16)31-14-4-9-26-10-12-27(13-11-26)18-15-19(28)25(3)21(30)24(18)2;/h5-8,15H,4,9-14H2,1-3H3,(H2,22,23,29);1H