2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydroquinazolin-4-olate

Systemtic Name: 2-[2-[methyl(phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5,6,7,8-tetrahydroquinazolin-4-olate Openeye Name: 2-[2-(N-methylanilino)-2-oxo-ethyl]sulfanyl-5,6,7,8-tetrahydroquinazolin-4-olate CAS Name: 2-[[2-(N-methylanilino)-2-oxoethyl]thio]-5,6,7,8-tetrahydroquinazolin-4-olate IUPAC Name: 2-[2-(N-methylanilino)-2-oxoethyl]sulfanyl-5,6,7,8-tetrahydroquinazolin-4-olate Traditional Name: 2-[[2-keto-2-(N-methylanilino)ethyl]thio]-5,6,7,8-tetrahydroquinazolin-4-olate Formula: C17H18N3O2S- MolecularWeight: 328.40872

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(CCCC3)C(=N2)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CSC2=NC3=C(CCCC3)C(=N2)[O-]

InChI

InChI=1S/C17H19N3O2S/c1-20(12-7-3-2-4-8-12)15(21)11-23-17-18-14-10-6-5-9-13(14)16(22)19-17/h2-4,7-8H,5-6,9-11H2,1H3,(H,18,19,22)/p-1