N-[(2S)-3-(1H-indol-3-yl)-1-[(4-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-3-(1H-indol-3-yl)-1-[(4-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-[(4-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-3-(1H-indol-3-yl)-1-[(4-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-3-(1H-indol-3-yl)-1-[(4-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-[(4-methyl-1,3-benzothiazol-2-yl)amino]ethyl]thiophene-2-carboxamide Formula: C24H20N4O2S2 MolecularWeight: 460.5712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)C5=CC=CS5

InChI

InChI=1S/C24H20N4O2S2/c1-14-6-4-9-19-21(14)27-24(32-19)28-22(29)18(26-23(30)20-10-5-11-31-20)12-15-13-25-17-8-3-2-7-16(15)17/h2-11,13,18,25H,12H2,1H3,(H,26,30)(H,27,28,29)/t18-/m0/s1