2-diethylaminoethyl 2-methylsulfanyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxylate chloride

Systemtic Name: 2-diethylaminoethyl 2-methylsulfanyl-11-oxidanylidene-pyrido[2,1-b]quinazoline-8-carboxylate chloride Openeye Name: 2-diethylaminoethyl 2-methylsulfanyl-11-oxo-pyrido[2,1-b]quinazoline-8-carboxylate chloride CAS Name: 2-(methylthio)-11-oxo-8-pyrido[2,1-b]quinazolinecarboxylic acid 2-diethylaminoethyl ester chloride IUPAC Name: 2-diethylaminoethyl 2-methylsulfanyl-11-oxopyrido[2,1-b]quinazoline-8-carboxylate chloride Traditional Name: 11-keto-2-(methylthio)pyrido[2,1-b]quinazoline-8-carboxylic acid 2-diethylaminoethyl ester chloride Formula: C20H23ClN3O3S- MolecularWeight: 420.93292

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CN2C(=NC3=C(C2=O)C=C(C=C3)SC)C=C1.[Cl-]

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CN2C(=NC3=C(C2=O)C=C(C=C3)SC)C=C1.[Cl-]

InChI

InChI=1S/C20H23N3O3S.ClH/c1-4-22(5-2)10-11-26-20(25)14-6-9-18-21-17-8-7-15(27-3)12-16(17)19(24)23(18)13-14;/h6-9,12-13H,4-5,10-11H2,1-3H3;1H/p-1