2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-[(3R)-3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-[(3R)-3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-[(5R)-3,5-bis(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C18H17N5OS3 MolecularWeight: 415.55548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2[C@H](CC(=N2)C3=CC=CS3)C4=CC=CS4)N

InChI

InChI=1S/C18H17N5OS3/c1-11-8-16(19)21-18(20-11)27-10-17(24)23-13(15-5-3-7-26-15)9-12(22-23)14-4-2-6-25-14/h2-8,13H,9-10H2,1H3,(H2,19,20,21)/t13-/m1/s1