N-(6-methyl-1,3-benzothiazol-2-yl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[1-(phenylmethyl)indol-3-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2-[[1-(phenylmethyl)-3-indolyl]thio]acetamide IUPAC Name: 2-(1-benzylindol-3-yl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(1-benzylindol-3-yl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C25H21N3OS2 MolecularWeight: 443.58374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C25H21N3OS2/c1-17-11-12-20-22(13-17)31-25(26-20)27-24(29)16-30-23-15-28(14-18-7-3-2-4-8-18)21-10-6-5-9-19(21)23/h2-13,15H,14,16H2,1H3,(H,26,27,29)