7-chloranyl-3-[3-[(4-methylphenyl)amino]-3-oxidanylidene-propyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-chloranyl-3-[3-[(4-methylphenyl)amino]-3-oxidanylidene-propyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-chloro-3-[3-(4-methylanilino)-3-oxo-propyl]-2-thioxo-quinazolin-4-olate CAS Name: 7-chloro-3-[3-(4-methylanilino)-3-oxopropyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-chloro-3-[3-(4-methylanilino)-3-oxopropyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-chloro-3-[3-keto-3-(p-toluidino)propyl]-2-thioxo-quinazolin-4-olate Formula: C18H15ClN3O2S- MolecularWeight: 372.8486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCN2C(=C3C=CC(=CC3=NC2=S)Cl)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCN2C(=C3C=CC(=CC3=NC2=S)Cl)[O-]

InChI

InChI=1S/C18H16ClN3O2S/c1-11-2-5-13(6-3-11)20-16(23)8-9-22-17(24)14-7-4-12(19)10-15(14)21-18(22)25/h2-7,10,24H,8-9H2,1H3,(H,20,23)/p-1