N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-2-oxoethyl]thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-2-oxoethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C17H18N4O3S3 MolecularWeight: 422.54482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C17H18N4O3S3/c1-9-6-14(21-24-9)20-16(23)10(2)26-8-15(22)18-11-4-5-12-13(7-11)27-17(19-12)25-3/h4-7,10H,8H2,1-3H3,(H,18,22)(H,20,21,23)