3-(3,5-dimethylphenyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-thioxo-1,5-dihydropyrimido[5,4-b]indol-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one IUPAC Name: 3-(3,5-dimethylphenyl)-2-sulfanylidene-1,5-dihydropyrimido[5,4-b]indol-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-thioxo-1,5-dihydropyrimid[5,4-b]indol-4-one Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)NC2=S)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4N3)NC2=S)C

InChI

InChI=1S/C18H15N3OS/c1-10-7-11(2)9-12(8-10)21-17(22)16-15(20-18(21)23)13-5-3-4-6-14(13)19-16/h3-9,19H,1-2H3,(H,20,23)