N-(3-chloranyl-2,6-diethyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C19H20ClN3O2S MolecularWeight: 389.899

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C19H20ClN3O2S/c1-3-12-5-6-15(20)13(4-2)17(12)22-16(24)7-9-23-11-21-18-14(19(23)25)8-10-26-18/h5-6,8,10-11H,3-4,7,9H2,1-2H3,(H,22,24)