4-methyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carbaldehyde

Systemtic Name: 4-methyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carbaldehyde Openeye Name: 4-methyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carbaldehyde CAS Name: 4-methyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxaldehyde IUPAC Name: 4-methyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carbaldehyde Traditional Name: 4-methyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carbaldehyde Formula: C13H13N2OS+ MolecularWeight: 245.32012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2[N+]3=C1SC=C3)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2[N+]3=C1SC=C3)C=O

InChI

InChI=1S/C13H13N2OS/c1-10-8-14(9-16)11-4-2-3-5-12(11)15-6-7-17-13(10)15/h2-7,9-10H,8H2,1H3/q+1