diethyl-[2-[(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)carbonylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)carbonylamino]ethyl]azanium Openeye Name: diethyl-[2-[(6-thioxo-5H-benzimidazolo[1,2-c]quinazoline-3-carbonyl)amino]ethyl]ammonium CAS Name: diethyl-[2-[[oxo-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(6-thioxo-5H-benzimidazolo[1,2-c]quinazoline-3-carbonyl)amino]ethyl]ammonium Formula: C21H24N5OS+ MolecularWeight: 394.51316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=S)N2

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=S)N2

InChI

InChI=1S/C21H23N5OS/c1-3-25(4-2)12-11-22-20(27)14-9-10-15-17(13-14)24-21(28)26-18-8-6-5-7-16(18)23-19(15)26/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,27)(H,24,28)/p+1