N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-3-methyl-benzamide Openeye Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]-3-methyl-benzamide CAS Name: N-[4-[[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylphenyl]-3-methylbenzamide Traditional Name: N-[4-[[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]thio]phenyl]-3-methyl-benzamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H23N3O3S2/c1-3-31-19-9-12-21-22(14-19)33-25(27-21)28-23(29)15-32-20-10-7-18(8-11-20)26-24(30)17-6-4-5-16(2)13-17/h4-14H,3,15H2,1-2H3,(H,26,30)(H,27,28,29)