2-[2-(3-azanyl-5-methyl-pyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[2-(3-azanyl-5-methyl-pyrazol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(phenylmethyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[2-(3-amino-5-methyl-pyrazol-1-yl)-2-oxo-ethyl]sulfanyl-3-benzyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-(3-amino-5-methyl-1-pyrazolyl)-2-oxoethyl]thio]-3-(phenylmethyl)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-[2-(3-amino-5-methylpyrazol-1-yl)-2-oxoethyl]sulfanyl-3-benzylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[2-(3-amino-5-methyl-pyrazol-1-yl)-2-keto-ethyl]thio]-3-benzyl-thieno[3,2-d]pyrimidin-4-one Formula: C19H17N5O2S2 MolecularWeight: 411.50058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3)N

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)SC=C3)N

InChI

InChI=1S/C19H17N5O2S2/c1-12-9-15(20)22-24(12)16(25)11-28-19-21-14-7-8-27-17(14)18(26)23(19)10-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H2,20,22)