6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(2-chlorophenyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C23H17ClN2O2S MolecularWeight: 420.91128

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=CC=C5Cl

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC4=C(C=C3)OCC(=O)N4)C5=CC=CC=C5Cl

InChI

InChI=1S/C23H17ClN2O2S/c24-16-6-2-1-5-15(16)22-12-18(25-17-7-3-4-8-21(17)29-22)14-9-10-20-19(11-14)26-23(27)13-28-20/h1-11,22H,12-13H2,(H,26,27)