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

Systemtic Name: 2-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[4-(2-amino-2-oxo-ethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[4-[(2-amino-2-oxoethyl)thio]-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-diethylammonium IUPAC Name: 2-[4-(2-amino-2-oxoethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-diethylazanium Traditional Name: 2-[4-[(2-amino-2-keto-ethyl)thio]-2-keto-5,6,7,8-tetrahydroquinazolin-1-yl]ethyl-diethyl-ammonium Formula: C16H27N4O2S+ MolecularWeight: 339.47618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O2S/c1-3-19(4-2)9-10-20-13-8-6-5-7-12(13)15(18-16(20)22)23-11-14(17)21/h3-11H2,1-2H3,(H2,17,21)/p+1