N,N-dimethyl-4-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N,N-dimethyl-4-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N,N-dimethyl-4-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-4-oxo-butanamide CAS Name: N,N-dimethyl-4-[4-[4-(3-methylphenoxy)-2-pyrimidinyl]-1-piperazinyl]-4-oxobutanamide IUPAC Name: N,N-dimethyl-4-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-4-oxobutanamide Traditional Name: 4-keto-N,N-dimethyl-4-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazino]butyramide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)C(=O)CCC(=O)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)C(=O)CCC(=O)N(C)C

InChI

InChI=1S/C21H27N5O3/c1-16-5-4-6-17(15-16)29-18-9-10-22-21(23-18)26-13-11-25(12-14-26)20(28)8-7-19(27)24(2)3/h4-6,9-10,15H,7-8,11-14H2,1-3H3