12-pyridin-4-yl-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine

Systemtic Name: 12-pyridin-4-yl-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine Openeye Name: 12-(4-pyridyl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine CAS Name: 12-pyridin-4-yl-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine IUPAC Name: 12-pyridin-4-yl-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine Traditional Name: 12-(4-pyridyl)-5H-[1,4]benzothiazino[2,3-c][1,5]benzothiazepine Formula: C20H13N3S2 MolecularWeight: 359.46732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC3=NC4=CC=CC=C4SC3=C(S2)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)NC3=NC4=CC=CC=C4SC3=C(S2)C5=CC=NC=C5

InChI

InChI=1S/C20H13N3S2/c1-3-7-16-14(5-1)22-20-19(18(24-16)13-9-11-21-12-10-13)25-17-8-4-2-6-15(17)23-20/h1-12H,(H,22,23)