N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[3-(4-chloranyl-3-methyl-phenoxy)-5-nitro-phenyl]-5-methyl-4-oxidanylidene-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-5-methyl-4-oxo-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-methyl-4-oxo-3-propyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[3-(4-chloro-3-methylphenoxy)-5-nitrophenyl]-5-methyl-4-oxo-3-propylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-[3-(4-chloro-3-methyl-phenoxy)-5-nitro-phenyl]-4-keto-5-methyl-3-propyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C24H21ClN4O5S MolecularWeight: 512.96534

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-])C

Isomeric SMILES

CCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC(=CC(=C3)OC4=CC(=C(C=C4)Cl)C)[N+](=O)[O-])C

InChI

InChI=1S/C24H21ClN4O5S/c1-4-7-28-12-26-23-20(24(28)31)14(3)21(35-23)22(30)27-15-9-16(29(32)33)11-18(10-15)34-17-5-6-19(25)13(2)8-17/h5-6,8-12H,4,7H2,1-3H3,(H,27,30)