N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[(1R)-2-(1H-indol-3-yl)-1-methyl-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[(2R)-1-(1H-indol-3-yl)propan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[(1R)-2-(1H-indol-3-yl)-1-methyl-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5

Isomeric SMILES

C[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5

InChI

InChI=1S/C23H20N4OS/c1-15(12-17-14-24-19-7-3-2-6-18(17)19)25-22(28)16-8-9-20-21(13-16)29-23(26-20)27-10-4-5-11-27/h2-11,13-15,24H,12H2,1H3,(H,25,28)/t15-/m1/s1