N-(4-bromanyl-2-methyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(4-bromo-2-methylphenyl)-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C16H14BrN3O2S/c1-10-8-11(17)2-3-13(10)19-14(21)4-6-20-9-18-15-12(16(20)22)5-7-23-15/h2-3,5,7-9H,4,6H2,1H3,(H,19,21)