9-(2-chloroethyl)-1,3-diphenyl-2-sulfanylidene-purin-6-one

Systemtic Name: 9-(2-chloroethyl)-1,3-diphenyl-2-sulfanylidene-purin-6-one Openeye Name: 9-(2-chloroethyl)-1,3-diphenyl-2-thioxo-purin-6-one CAS Name: 9-(2-chloroethyl)-1,3-diphenyl-2-sulfanylidene-6-purinone IUPAC Name: 9-(2-chloroethyl)-1,3-diphenyl-2-sulfanylidenepurin-6-one Traditional Name: 9-(2-chloroethyl)-1,3-diphenyl-2-thioxo-purin-6-one Formula: C19H15ClN4OS MolecularWeight: 382.8666

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=S)C4=CC=CC=C4)N=CN3CCCl

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=S)C4=CC=CC=C4)N=CN3CCCl

InChI

InChI=1S/C19H15ClN4OS/c20-11-12-22-13-21-16-17(22)23(14-7-3-1-4-8-14)19(26)24(18(16)25)15-9-5-2-6-10-15/h1-10,13H,11-12H2