N-(3-chloranyl-4-methoxy-phenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide CAS Name: N-(3-chloro-4-methoxyphenyl)-4-methyl-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-4-methyl-2-(4-methylpiperazino)pyrimidine-5-carboxamide Formula: C18H22ClN5O2 MolecularWeight: 375.85258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)OC)Cl)N3CCN(CC3)C

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)OC)Cl)N3CCN(CC3)C

InChI

InChI=1S/C18H22ClN5O2/c1-12-14(11-20-18(21-12)24-8-6-23(2)7-9-24)17(25)22-13-4-5-16(26-3)15(19)10-13/h4-5,10-11H,6-9H2,1-3H3,(H,22,25)