2-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[4-(2-amino-2-oxo-ethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[4-[(2-amino-2-oxoethyl)thio]-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[4-(2-amino-2-oxoethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[4-[(2-amino-2-keto-ethyl)thio]-2-keto-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-dimethyl-ammonium Formula: C14H23N4O2S+ MolecularWeight: 311.42302

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)N

Isomeric SMILES

C[NH+](C)CCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)N

InChI

InChI=1S/C14H22N4O2S/c1-17(2)7-8-18-11-6-4-3-5-10(11)13(16-14(18)20)21-9-12(15)19/h3-9H2,1-2H3,(H2,15,19)/p+1