4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-methyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]benzamide CAS Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-methyl-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]benzamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide Traditional Name: 4-[(1,3-benzothiazol-2-ylthio)methyl]-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-methyl-benzamide Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(C)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N4O3S2/c1-14-11-19(25-29-14)24-20(27)12-26(2)21(28)16-9-7-15(8-10-16)13-30-22-23-17-5-3-4-6-18(17)31-22/h3-11H,12-13H2,1-2H3,(H,24,25,27)