N-(1,3-benzothiazol-2-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-N-(2-sulfanylethyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-N-(2-sulfanylethyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-N-(2-sulfanylethyl)acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-N-(2-mercaptoethyl)-2-(2-phenyl-1H-indol-3-yl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-(2-phenyl-1H-indol-3-yl)-N-(2-sulfanylethyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-N-(2-mercaptoethyl)-2-(2-phenyl-1H-indol-3-yl)acetamide Formula: C26H23N3OS2 MolecularWeight: 457.61032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CC(=O)N(CCS)CC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CC(=O)N(CCS)CC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H23N3OS2/c30-25(29(14-15-31)17-24-27-22-12-6-7-13-23(22)32-24)16-20-19-10-4-5-11-21(19)28-26(20)18-8-2-1-3-9-18/h1-13,28,31H,14-17H2