3-[(3-chlorophenyl)methyl]-8-propan-2-yl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 3-[(3-chlorophenyl)methyl]-8-propan-2-yl-6-sulfanylidene-7H-purin-2-one Openeye Name: 3-[(3-chlorophenyl)methyl]-8-isopropyl-6-thioxo-7H-purin-2-one CAS Name: 3-[(3-chlorophenyl)methyl]-8-propan-2-yl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 3-[(3-chlorophenyl)methyl]-8-propan-2-yl-6-sulfanylidene-7H-purin-2-one Traditional Name: 3-(3-chlorobenzyl)-8-isopropyl-6-thioxo-7H-purin-2-one Formula: C15H15ClN4OS MolecularWeight: 334.8238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(N1)C(=S)NC(=O)N2CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)C1=NC2=C(N1)C(=S)NC(=O)N2CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C15H15ClN4OS/c1-8(2)12-17-11-13(18-12)20(15(21)19-14(11)22)7-9-4-3-5-10(16)6-9/h3-6,8H,7H2,1-2H3,(H,17,18)(H,19,21,22)