N-(4-butylphenyl)-3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(4-butylphenyl)-3-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(4-butylphenyl)-3-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(4-butylphenyl)-3-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(4-butylphenyl)-3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(4-butylphenyl)-3-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCN2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C21H25N3O2S/c1-4-5-6-16-7-9-17(10-8-16)23-18(25)11-12-24-13-22-20-19(21(24)26)14(2)15(3)27-20/h7-10,13H,4-6,11-12H2,1-3H3,(H,23,25)