N-[2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide

Systemtic Name: N-[2-[1-[(4-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide Openeye Name: N-[2-[2-(4-ethoxyanilino)-1-methyl-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-methyl-benzamide CAS Name: N-[2-[[1-(4-ethoxyanilino)-1-oxopropan-2-yl]thio]-1,3-benzothiazol-6-yl]-4-methylbenzamide IUPAC Name: N-[2-[1-(4-ethoxyanilino)-1-oxopropan-2-yl]sulfanyl-1,3-benzothiazol-6-yl]-4-methylbenzamide Traditional Name: N-[2-[[2-keto-1-methyl-2-(p-phenetidino)ethyl]thio]-1,3-benzothiazol-6-yl]-4-methyl-benzamide Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H25N3O3S2/c1-4-32-21-12-9-19(10-13-21)27-24(30)17(3)33-26-29-22-14-11-20(15-23(22)34-26)28-25(31)18-7-5-16(2)6-8-18/h5-15,17H,4H2,1-3H3,(H,27,30)(H,28,31)