4,5-diphenyl-7-phenylazanyl-1,4-thiazepin-4-ium-3-one

Systemtic Name: 4,5-diphenyl-7-phenylazanyl-1,4-thiazepin-4-ium-3-one Openeye Name: 7-anilino-4,5-diphenyl-1,4-thiazepin-4-ium-3-one CAS Name: 7-anilino-4,5-diphenyl-1,4-thiazepin-4-ium-3-one IUPAC Name: 7-anilino-4,5-diphenyl-1,4-thiazepin-4-ium-3-one Traditional Name: 7-anilino-4,5-diphenyl-1,4-thiazepin-4-ium-3-one Formula: C23H19N2OS+ MolecularWeight: 371.47476

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)[N+](=C(C=C(S1)NC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)[N+](=C(C=C(S1)NC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2OS/c26-23-17-27-22(24-19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)25(23)20-14-8-3-9-15-20/h1-16H,17H2/p+1