4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-(2-methoxyphenyl)benzamide

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-(2-methoxyphenyl)benzamide Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-(2-methoxyphenyl)benzamide CAS Name: 4-[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]amino]-N-(2-methoxyphenyl)benzamide IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-(2-methoxyphenyl)benzamide Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-N-(2-methoxyphenyl)benzamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H23N3O3S/c1-31-21-9-4-2-7-19(21)28-25(30)17-13-15-18(16-14-17)26-23(29)11-6-12-24-27-20-8-3-5-10-22(20)32-24/h2-5,7-10,13-16H,6,11-12H2,1H3,(H,26,29)(H,28,30)