methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(2R)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl]azanium

Systemtic Name: methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[(2R)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl]azanium Openeye Name: methyl-[(1R)-1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl]-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl]ammonium IUPAC Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[(2R)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(2-thenylamino)ethyl]-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C18H21N4O2S+ MolecularWeight: 357.44994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)[NH+](C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CS1)[NH+](C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H20N4O2S/c1-12(17(23)19-10-13-6-5-9-25-13)22(2)11-16-20-15-8-4-3-7-14(15)18(24)21-16/h3-9,12H,10-11H2,1-2H3,(H,19,23)(H,20,21,24)/p+1/t12-/m1/s1