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

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)ethanamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-2-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylsulfanyl)acetamide CAS Name: N-(4-methoxy-2-nitrophenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylthio)acetamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)acetamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-2-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-ylthio)acetamide Formula: C19H18N4O4S2 MolecularWeight: 430.50062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC=NC3=C2C4=C(S3)CCCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC=NC3=C2C4=C(S3)CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4S2/c1-27-11-6-7-13(14(8-11)23(25)26)22-16(24)9-28-18-17-12-4-2-3-5-15(12)29-19(17)21-10-20-18/h6-8,10H,2-5,9H2,1H3,(H,22,24)