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S-[[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl] carbamothioate hydrochloride

S-[[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl] carbamothioate hydrochloride

Systemtic Name:S-[[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl] carbamothioate hydrochloride
Openeye Name:S-[[3-(o-tolyl)-4-oxo-quinazolin-2-yl]methyl] carbamothioate hydrochloride
CAS Name:carbamothioic acid S-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]methyl] ester hydrochloride
IUPAC Name:S-[[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]methyl] carbamothioate hydrochloride
Traditional Name:thiocarbamic acid S-[[4-keto-3-(o-tolyl)quinazolin-2-yl]methyl] ester hydrochloride
Formula: C17H16ClN3O2S
MolecularWeight: 361.84584
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CSC(=O)N.Cl


Isomeric SMILES

CC1=CC=CC=C1N2C(=NC3=CC=CC=C3C2=O)CSC(=O)N.Cl


InChI

InChI=1S/C17H15N3O2S.ClH/c1-11-6-2-5-9-14(11)20-15(10-23-17(18)22)19-13-8-4-3-7-12(13)16(20)21;/h2-9H,10H2,1H3,(H2,18,22);1H


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