N-(2-methyl-4-nitro-phenyl)-2-(4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(2-methyl-4-nitro-phenyl)-2-(4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(2-methyl-4-nitro-phenyl)-2-(4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(2-methyl-4-nitrophenyl)-2-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide IUPAC Name: N-(2-methyl-4-nitrophenyl)-2-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)-N-(2-methyl-4-nitro-phenyl)acetamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C4=C(S3)CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C4=C(S3)CCCC4

InChI

InChI=1S/C19H18N4O4S/c1-11-8-12(23(26)27)6-7-14(11)21-16(24)9-22-10-20-18-17(19(22)25)13-4-2-3-5-15(13)28-18/h6-8,10H,2-5,9H2,1H3,(H,21,24)