5-bromanyl-3-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]amino]-7-methyl-indol-2-one

Systemtic Name: 5-bromanyl-3-[[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]amino]-7-methyl-indol-2-one Openeye Name: 5-bromo-3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]anilino]-7-methyl-indol-2-one CAS Name: 5-bromo-3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]anilino]-7-methyl-2-indolone IUPAC Name: 5-bromo-3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]anilino]-7-methylindol-2-one Traditional Name: 5-bromo-3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]anilino]-7-methyl-indol-2-one Formula: C20H17BrN4OS MolecularWeight: 441.34418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C(C(=O)N=C12)NC3=CC=CC=C3SC4=C(NN=C4C)C)Br

Isomeric SMILES

CC1=CC(=CC2=C(C(=O)N=C12)NC3=CC=CC=C3SC4=C(NN=C4C)C)Br

InChI

InChI=1S/C20H17BrN4OS/c1-10-8-13(21)9-14-17(10)23-20(26)18(14)22-15-6-4-5-7-16(15)27-19-11(2)24-25-12(19)3/h4-9H,1-3H3,(H,24,25)(H,22,23,26)