N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-thiazole-5-carboxamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-5-thiazolecarboxamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-1,3-thiazole-5-carboxamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-methyl-4-phenyl-thiazole-5-carboxamide Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)NCC2=CC3=C(C(=C2)Cl)OCCCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=C(S1)C(=O)NCC2=CC3=C(C(=C2)Cl)OCCCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H19ClN2O3S/c1-13-24-18(15-6-3-2-4-7-15)20(28-13)21(25)23-12-14-10-16(22)19-17(11-14)26-8-5-9-27-19/h2-4,6-7,10-11H,5,8-9,12H2,1H3,(H,23,25)