[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H21N4O2S+ MolecularWeight: 357.44994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C18H20N4O2S/c1-12-7-8-25-15(12)9-21(2)11-17-20-14-6-4-3-5-13(14)18(24)22(17)10-16(19)23/h3-8H,9-11H2,1-2H3,(H2,19,23)/p+1