(2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]propan-1-one Formula: C18H13N3O3S2 MolecularWeight: 383.44412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O3S2/c1-10(17(22)13-9-19-14-5-3-2-4-12(13)14)25-18-20-15-7-6-11(21(23)24)8-16(15)26-18/h2-10,19H,1H3/t10-/m1/s1