9-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxidanylidene-7H-purine-6-carboxamide

Systemtic Name: 9-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxidanylidene-7H-purine-6-carboxamide Openeye Name: 9-(4-chlorophenyl)-2-(3-methyl-2-thienyl)-8-oxo-7H-purine-6-carboxamide CAS Name: 9-(4-chlorophenyl)-2-(3-methyl-2-thiophenyl)-8-oxo-7H-purine-6-carboxamide IUPAC Name: 9-(4-chlorophenyl)-2-(3-methylthiophen-2-yl)-8-oxo-7H-purine-6-carboxamide Traditional Name: 9-(4-chlorophenyl)-8-keto-2-(3-methyl-2-thienyl)-7H-purine-6-carboxamide Formula: C17H12ClN5O2S MolecularWeight: 385.82748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)Cl)C(=O)N

Isomeric SMILES

CC1=C(SC=C1)C2=NC(=C3C(=N2)N(C(=O)N3)C4=CC=C(C=C4)Cl)C(=O)N

InChI

InChI=1S/C17H12ClN5O2S/c1-8-6-7-26-13(8)15-20-11(14(19)24)12-16(22-15)23(17(25)21-12)10-4-2-9(18)3-5-10/h2-7H,1H3,(H2,19,24)(H,21,25)