[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-(5-methylthiophen-2-yl)methanone

Systemtic Name: [4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-(5-methylthiophen-2-yl)methanone Openeye Name: [4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-(5-methyl-2-thienyl)methanone CAS Name: [4-[4-(3-methylphenoxy)-2-pyrimidinyl]-1-piperazinyl]-(5-methyl-2-thiophenyl)methanone IUPAC Name: [4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]-(5-methylthiophen-2-yl)methanone Traditional Name: [4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazino]-(5-methyl-2-thienyl)methanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)C(=O)C4=CC=C(S4)C

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)C(=O)C4=CC=C(S4)C

InChI

InChI=1S/C21H22N4O2S/c1-15-4-3-5-17(14-15)27-19-8-9-22-21(23-19)25-12-10-24(11-13-25)20(26)18-7-6-16(2)28-18/h3-9,14H,10-13H2,1-2H3