5-(2-chlorophenyl)-1-methyl-7-(2-oxidanylpropylsulfanyl)-6H-pteridine-2,4-dione

Systemtic Name: 5-(2-chlorophenyl)-1-methyl-7-(2-oxidanylpropylsulfanyl)-6H-pteridine-2,4-dione Openeye Name: 5-(2-chlorophenyl)-7-(2-hydroxypropylsulfanyl)-1-methyl-6H-pteridine-2,4-dione CAS Name: 5-(2-chlorophenyl)-7-(2-hydroxypropylthio)-1-methyl-6H-pteridine-2,4-dione IUPAC Name: 5-(2-chlorophenyl)-7-(2-hydroxypropylsulfanyl)-1-methyl-6H-pteridine-2,4-dione Traditional Name: 5-(2-chlorophenyl)-7-(2-hydroxypropylthio)-1-methyl-6H-pteridine-2,4-quinone Formula: C16H17ClN4O3S MolecularWeight: 380.84918

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC2=C(C(=O)NC(=O)N2C)N(C1)C3=CC=CC=C3Cl)O

Isomeric SMILES

CC(CSC1=NC2=C(C(=O)NC(=O)N2C)N(C1)C3=CC=CC=C3Cl)O

InChI

InChI=1S/C16H17ClN4O3S/c1-9(22)8-25-12-7-21(11-6-4-3-5-10(11)17)13-14(18-12)20(2)16(24)19-15(13)23/h3-6,9,22H,7-8H2,1-2H3,(H,19,23,24)