(3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3R)-N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=C(C=C3)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)C(=O)NC3=CC=C(C=C3)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H18N2O3S/c26-23(20-14-27-18-6-2-3-7-19(18)28-20)24-16-11-9-15(10-12-16)13-22-25-17-5-1-4-8-21(17)29-22/h1-12,20H,13-14H2,(H,24,26)/t20-/m1/s1