N-(1,3-benzothiazol-2-yl)-6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C17H13ClN2O3S MolecularWeight: 360.81472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)C(=O)NC3=NC4=CC=CC=C4S3)Cl)OC1

InChI

InChI=1S/C17H13ClN2O3S/c18-11-8-10(9-13-15(11)23-7-3-6-22-13)16(21)20-17-19-12-4-1-2-5-14(12)24-17/h1-2,4-5,8-9H,3,6-7H2,(H,19,20,21)