3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-5-nitro-indol-2-one

Systemtic Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-5-nitro-indol-2-one Openeye Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-5-nitro-indol-2-one CAS Name: 3-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-5-nitro-2-indolone IUPAC Name: 3-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-5-nitroindol-2-one Traditional Name: 3-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-5-nitro-indol-2-one Formula: C16H10N4O3S2 MolecularWeight: 370.4056

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O3S2/c1-24-16-19-12-4-2-8(6-13(12)25-16)17-14-10-7-9(20(22)23)3-5-11(10)18-15(14)21/h2-7H,1H3,(H,17,18,21)