N-(2,6-dimethylphenyl)-2-[2-(3-methoxyphenyl)ethanoylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[2-(3-methoxyphenyl)ethanoylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-[[2-(3-methoxyphenyl)acetyl]amino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[2-(3-methoxyphenyl)-1-oxoethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[[2-(3-methoxyphenyl)acetyl]amino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[2-(3-methoxyphenyl)acetyl]amino]-1,3-benzothiazole-6-carboxamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C25H23N3O3S/c1-15-6-4-7-16(2)23(15)28-24(30)18-10-11-20-21(14-18)32-25(26-20)27-22(29)13-17-8-5-9-19(12-17)31-3/h4-12,14H,13H2,1-3H3,(H,28,30)(H,26,27,29)