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

Systemtic Name: 6-chloranyl-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-(4-methyl-1,3-benzothiazol-2-yl)-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C18H15ClN2O3S/c1-10-4-2-5-14-15(10)20-18(25-14)21-17(22)11-8-12(19)16-13(9-11)23-6-3-7-24-16/h2,4-5,8-9H,3,6-7H2,1H3,(H,20,21,22)