3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-methyl-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-4-methoxy-N-methyl-benzamide Formula: C21H28N4O6S MolecularWeight: 464.53522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H28N4O6S/c1-15-12-19(23-31-15)22-20(26)14-24(2)21(27)16-8-9-17(30-3)18(13-16)32(28,29)25-10-6-4-5-7-11-25/h8-9,12-13H,4-7,10-11,14H2,1-3H3,(H,22,23,26)