(2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-(1-thiophen-2-ylcarbonylpiperidin-4-yl)ethanone

Systemtic Name: (2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-(1-thiophen-2-ylcarbonylpiperidin-4-yl)ethanone Openeye Name: (2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-[1-(thiophene-2-carbonyl)-4-piperidyl]ethanone CAS Name: (2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]ethanone IUPAC Name: (2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-[1-(thiophene-2-carbonyl)piperidin-4-yl]ethanone Traditional Name: (2E)-2-(2,2-dimethyl-3H-1,3-benzoxazin-4-ylidene)-1-[1-(2-thenoyl)-4-piperidyl]ethanone Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1(NC(=CC(=O)C2CCN(CC2)C(=O)C3=CC=CS3)C4=CC=CC=C4O1)C

Isomeric SMILES

CC1(N/C(=C/C(=O)C2CCN(CC2)C(=O)C3=CC=CS3)/C4=CC=CC=C4O1)C

InChI

InChI=1S/C22H24N2O3S/c1-22(2)23-17(16-6-3-4-7-19(16)27-22)14-18(25)15-9-11-24(12-10-15)21(26)20-8-5-13-28-20/h3-8,13-15,23H,9-12H2,1-2H3/b17-14+