1-(1,3-benzoxazol-2-ylsulfanylmethyl)-4-phenyl-3H-1,5-benzodiazepin-2-one

Systemtic Name: 1-(1,3-benzoxazol-2-ylsulfanylmethyl)-4-phenyl-3H-1,5-benzodiazepin-2-one Openeye Name: 1-(1,3-benzoxazol-2-ylsulfanylmethyl)-4-phenyl-3H-1,5-benzodiazepin-2-one CAS Name: 1-[(1,3-benzoxazol-2-ylthio)methyl]-4-phenyl-3H-1,5-benzodiazepin-2-one IUPAC Name: 1-(1,3-benzoxazol-2-ylsulfanylmethyl)-4-phenyl-3H-1,5-benzodiazepin-2-one Traditional Name: 1-[(1,3-benzoxazol-2-ylthio)methyl]-4-phenyl-3H-1,5-benzodiazepin-2-one Formula: C23H17N3O2S MolecularWeight: 399.46498

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=CC=CC=C2N(C1=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

C1C(=NC2=CC=CC=C2N(C1=O)CSC3=NC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C23H17N3O2S/c27-22-14-19(16-8-2-1-3-9-16)24-17-10-4-6-12-20(17)26(22)15-29-23-25-18-11-5-7-13-21(18)28-23/h1-13H,14-15H2