N-(1,3-benzothiazol-2-yl)-3,3,3-triphenyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3,3,3-triphenyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3,3,3-triphenyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3,3,3-triphenylpropanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3,3,3-triphenylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3,3,3-triphenyl-propionamide Formula: C28H22N2OS MolecularWeight: 434.55208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC2=NC3=CC=CC=C3S2)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NC2=NC3=CC=CC=C3S2)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H22N2OS/c31-26(30-27-29-24-18-10-11-19-25(24)32-27)20-28(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-19H,20H2,(H,29,30,31)