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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

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