N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanamide

Systemtic Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanamide Openeye Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(3-methylisoxazol-5-yl)acetamide CAS Name: N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]-2-(3-methyl-5-isoxazolyl)acetamide IUPAC Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: 2-(3-methylisoxazol-5-yl)-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C21H19N3O3S2 MolecularWeight: 425.52386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC

Isomeric SMILES

CC1=NOC(=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC

InChI

InChI=1S/C21H19N3O3S2/c1-13-9-16(27-24-13)11-20(25)22-15-7-8-17-19(10-15)29-21(23-17)28-12-14-5-3-4-6-18(14)26-2/h3-10H,11-12H2,1-2H3,(H,22,25)