4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)-N-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)-N-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbothioamide CAS Name: 4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-N-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbothioamide Traditional Name: N-benzyl-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbothioamide Formula: C20H27N5S MolecularWeight: 369.52688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C20H27N5S/c1-15(2)19-22-16(3)13-18(23-19)24-9-11-25(12-10-24)20(26)21-14-17-7-5-4-6-8-17/h4-8,13,15H,9-12,14H2,1-3H3,(H,21,26)