3-(3-methylbutyl)-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3-methylbutyl)-2-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)sulfanyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-isopentyl-2-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3-methylbutyl)-2-[[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]thio]-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3-methylbutyl)-2-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)sulfanyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-isoamyl-2-[(2-keto-1-methyl-2-pyrrolidino-ethyl)thio]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H27N3O2S3 MolecularWeight: 461.66368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCCC3)SC=C2C4=CC=CS4

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(N=C1SC(C)C(=O)N3CCCC3)SC=C2C4=CC=CS4

InChI

InChI=1S/C22H27N3O2S3/c1-14(2)8-11-25-21(27)18-16(17-7-6-12-28-17)13-29-19(18)23-22(25)30-15(3)20(26)24-9-4-5-10-24/h6-7,12-15H,4-5,8-11H2,1-3H3