4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(2,2-diphenylethyl)butyramide Formula: C25H24N2OS MolecularWeight: 400.53586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)CCCC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)CCCC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2OS/c28-24(16-9-17-25-27-22-14-7-8-15-23(22)29-25)26-18-21(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-15,21H,9,16-18H2,(H,26,28)