3-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-azanium

Systemtic Name: 3-[4-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-2-oxidanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-azanium Openeye Name: 3-[4-(2-amino-2-oxo-ethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-ammonium CAS Name: 3-[4-[(2-amino-2-oxoethyl)thio]-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethylammonium IUPAC Name: 3-[4-(2-amino-2-oxoethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethylazanium Traditional Name: 3-[4-[(2-amino-2-keto-ethyl)thio]-2-keto-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-ammonium Formula: C17H29N4O2S+ MolecularWeight: 353.50276

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)N

Isomeric SMILES

CC[NH+](CC)CCCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)N

InChI

InChI=1S/C17H28N4O2S/c1-3-20(4-2)10-7-11-21-14-9-6-5-8-13(14)16(19-17(21)23)24-12-15(18)22/h3-12H2,1-2H3,(H2,18,22)/p+1