N-[1-(4-tert-butylphenyl)ethyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[1-(4-tert-butylphenyl)ethyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[1-(4-tert-butylphenyl)ethyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-[1-(4-tert-butylphenyl)ethyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-[1-(4-tert-butylphenyl)ethyl]-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C21H25N3O2S/c1-14(15-5-7-16(8-6-15)21(2,3)4)23-18(25)9-11-24-13-22-19-17(20(24)26)10-12-27-19/h5-8,10,12-14H,9,11H2,1-4H3,(H,23,25)