N-phenyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide

Systemtic Name: N-phenyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide Openeye Name: N-phenyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide CAS Name: N-phenyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide IUPAC Name: N-phenyl-4,5-dihydro-[1,3]thiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide Traditional Name: N-phenyl-4,5-dihydrothiazolo[2,3-d][1,5]benzodiazepin-11-ium-6-carboxamide Formula: C18H16N3OS+ MolecularWeight: 322.40414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2[N+]3=C1SC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(C2=CC=CC=C2[N+]3=C1SC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H15N3OS/c22-18(19-14-6-2-1-3-7-14)21-11-10-17-20(12-13-23-17)15-8-4-5-9-16(15)21/h1-9,12-13H,10-11H2/p+1