3-[2-(2-acetamidoethylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]propyl-diethyl-azanium

Systemtic Name: 3-[2-(2-acetamidoethylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]propyl-diethyl-azanium Openeye Name: 3-[2-(2-acetamidoethylsulfanyl)-4-oxo-quinazolin-3-yl]propyl-diethyl-ammonium CAS Name: 3-[2-(2-acetamidoethylthio)-4-oxo-3-quinazolinyl]propyl-diethylammonium IUPAC Name: 3-[2-(2-acetamidoethylsulfanyl)-4-oxoquinazolin-3-yl]propyl-diethylazanium Traditional Name: 3-[2-(2-acetamidoethylthio)-4-keto-quinazolin-3-yl]propyl-diethyl-ammonium Formula: C19H29N4O2S+ MolecularWeight: 377.52416

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCCNC(=O)C

Isomeric SMILES

CC[NH+](CC)CCCN1C(=O)C2=CC=CC=C2N=C1SCCNC(=O)C

InChI

InChI=1S/C19H28N4O2S/c1-4-22(5-2)12-8-13-23-18(25)16-9-6-7-10-17(16)21-19(23)26-14-11-20-15(3)24/h6-7,9-10H,4-5,8,11-14H2,1-3H3,(H,20,24)/p+1