N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]-4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C17H27N5O3S MolecularWeight: 381.49298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H27N5O3S/c1-12(2)16-18-13(3)10-15(20-16)21-5-7-22(8-6-21)17(23)19-14-4-9-26(24,25)11-14/h10,12,14H,4-9,11H2,1-3H3,(H,19,23)/t14-/m0/s1