3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-5-nitro-indol-2-one

Systemtic Name: 3-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-5-nitro-indol-2-one Openeye Name: 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-5-nitro-indol-2-one CAS Name: 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-5-nitro-2-indolone IUPAC Name: 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-5-nitroindol-2-one Traditional Name: 3-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-5-nitro-indol-2-one Formula: C22H14N4O3S MolecularWeight: 414.43656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=NC4=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=C5C=C(C=CC5=NC4=O)[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O3S/c1-12-2-8-18-19(10-12)30-22(25-18)13-3-5-14(6-4-13)23-20-16-11-15(26(28)29)7-9-17(16)24-21(20)27/h2-11H,1H3,(H,23,24,27)