4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxidanylidene-butanamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(2-methylthiazol-4-yl)phenyl]-4-oxo-butanamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(2-methyl-4-thiazolyl)phenyl]-4-oxobutanamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-oxobutanamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-keto-N-[4-(2-methylthiazol-4-yl)phenyl]butyramide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)CCC(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)CCC(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H22N2O4S/c1-15-24-19(14-30-15)16-3-6-18(7-4-16)25-23(27)10-8-20(26)17-5-9-21-22(13-17)29-12-2-11-28-21/h3-7,9,13-14H,2,8,10-12H2,1H3,(H,25,27)