N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(5-methyl-2-thienyl)-4-oxo-butanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(5-methyl-2-thiophenyl)-4-oxobutanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-(5-methylthiophen-2-yl)-4-oxobutanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-4-(5-methyl-2-thienyl)butyramide Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H19NO4S/c1-12-3-7-17(24-12)14(20)5-8-18(21)19-13-4-6-15-16(11-13)23-10-2-9-22-15/h3-4,6-7,11H,2,5,8-10H2,1H3,(H,19,21)