5-(3-chlorophenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3-chlorophenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-benzyl-5-(3-chlorophenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3-chlorophenyl)-6-methyl-3-(phenylmethyl)-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-benzyl-5-(3-chlorophenyl)-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-benzyl-5-(3-chlorophenyl)-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C20H15ClN2OS2 MolecularWeight: 398.9289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)NC(=S)N(C2=O)CC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C2=C(S1)NC(=S)N(C2=O)CC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H15ClN2OS2/c1-12-16(14-8-5-9-15(21)10-14)17-18(26-12)22-20(25)23(19(17)24)11-13-6-3-2-4-7-13/h2-10H,11H2,1H3,(H,22,25)