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

Systemtic Name: diethyl-[3-[2-oxidanylidene-4-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-5,6,7,8-tetrahydroquinazolin-1-yl]propyl]azanium Openeye Name: 3-[4-(2-anilino-2-oxo-ethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-ammonium CAS Name: 3-[4-[(2-anilino-2-oxoethyl)thio]-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethylammonium IUPAC Name: 3-[4-(2-anilino-2-oxoethyl)sulfanyl-2-oxo-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethylazanium Traditional Name: 3-[4-[(2-anilino-2-keto-ethyl)thio]-2-keto-5,6,7,8-tetrahydroquinazolin-1-yl]propyl-diethyl-ammonium Formula: C23H33N4O2S+ MolecularWeight: 429.59872

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCN1C2=C(CCCC2)C(=NC1=O)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H32N4O2S/c1-3-26(4-2)15-10-16-27-20-14-9-8-13-19(20)22(25-23(27)29)30-17-21(28)24-18-11-6-5-7-12-18/h5-7,11-12H,3-4,8-10,13-17H2,1-2H3,(H,24,28)/p+1