N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carbothioamide

Systemtic Name: N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carbothioamide Openeye Name: N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carbothioamide CAS Name: N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methyl-4-pyrimidinyl]-1-piperazinecarbothioamide IUPAC Name: N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methylpyrimidin-4-yl]piperazine-1-carbothioamide Traditional Name: N-cyclopropyl-4-[6-(4-methoxyphenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carbothioamide Formula: C20H25N5OS MolecularWeight: 383.5104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)N2CCN(CC2)C(=S)NC3CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=CC(=N1)N2CCN(CC2)C(=S)NC3CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H25N5OS/c1-14-21-18(15-3-7-17(26-2)8-4-15)13-19(22-14)24-9-11-25(12-10-24)20(27)23-16-5-6-16/h3-4,7-8,13,16H,5-6,9-12H2,1-2H3,(H,23,27)