N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-benzamide

Systemtic Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-benzamide Openeye Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methyl-benzamide CAS Name: N-[2-[[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-2-methylbenzamide IUPAC Name: N-[2-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-methylbenzamide Traditional Name: N-[2-[[2-keto-2-(p-anisylamino)ethyl]thio]-1,3-benzothiazol-6-yl]-2-methyl-benzamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H23N3O3S2/c1-16-5-3-4-6-20(16)24(30)27-18-9-12-21-22(13-18)33-25(28-21)32-15-23(29)26-14-17-7-10-19(31-2)11-8-17/h3-13H,14-15H2,1-2H3,(H,26,29)(H,27,30)