[4-(1,3-dithian-2-yl)phenyl]-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: [4-(1,3-dithian-2-yl)phenyl]-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]methanone Formula: C23H30N4OS2 MolecularWeight: 442.6405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4SCCCS4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4SCCCS4

InChI

InChI=1S/C23H30N4OS2/c1-16(2)21-24-17(3)15-20(25-21)26-9-11-27(12-10-26)22(28)18-5-7-19(8-6-18)23-29-13-4-14-30-23/h5-8,15-16,23H,4,9-14H2,1-3H3