2-ethyl-10-oxidanylidene-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-amine

Systemtic Name: 2-ethyl-10-oxidanylidene-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-amine Openeye Name: 2-ethyl-10-oxo-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-amine CAS Name: 2-ethyl-10-oxo-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-amine IUPAC Name: 2-ethyl-10-oxo-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-amine Traditional Name: (2-ethyl-10-keto-4,5,8,9-tetrahydrothieno[3,2-c][1,5]benzodiazepin-10-ium-7-yl)amine Formula: C13H16N3OS+ MolecularWeight: 262.35064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)[N+](=O)C3=C(C=C(CC3)N)NC2

Isomeric SMILES

CCC1=CC2=C(S1)[N+](=O)C3=C(C=C(CC3)N)NC2

InChI

InChI=1S/C13H16N3OS/c1-2-10-5-8-7-15-11-6-9(14)3-4-12(11)16(17)13(8)18-10/h5-6,15H,2-4,7,14H2,1H3/q+1