(2S)-2-thiophen-2-yl-1,2,3,4-tetrahydroquinazolin-3-ium

Systemtic Name: (2S)-2-thiophen-2-yl-1,2,3,4-tetrahydroquinazolin-3-ium Openeye Name: (2S)-2-(2-thienyl)-1,2,3,4-tetrahydroquinazolin-3-ium CAS Name: (2S)-2-thiophen-2-yl-1,2,3,4-tetrahydroquinazolin-3-ium IUPAC Name: (2S)-2-thiophen-2-yl-1,2,3,4-tetrahydroquinazolin-3-ium Traditional Name: (2S)-2-(2-thienyl)-1,2,3,4-tetrahydroquinazolin-3-ium Formula: C12H13N2S+ MolecularWeight: 217.31002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2NC([NH2+]1)C3=CC=CS3

Isomeric SMILES

C1C2=CC=CC=C2N[C@@H]([NH2+]1)C3=CC=CS3

InChI

InChI=1S/C12H12N2S/c1-2-5-10-9(4-1)8-13-12(14-10)11-6-3-7-15-11/h1-7,12-14H,8H2/p+1/t12-/m1/s1