3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(1,5-diphenyl-1,2,4-triazol-3-yl)methanone Formula: C24H20N4OS MolecularWeight: 412.5068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3=NN(C(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H20N4OS/c29-24(27-16-9-17-30-21-15-8-7-14-20(21)27)22-25-23(18-10-3-1-4-11-18)28(26-22)19-12-5-2-6-13-19/h1-8,10-15H,9,16-17H2