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

Systemtic Name: 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]imino-1,7-dimethyl-5-nitro-indol-2-one Openeye Name: 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]imino-1,7-dimethyl-5-nitro-indolin-2-one CAS Name: 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]phenyl]imino-1,7-dimethyl-5-nitro-2-indolone IUPAC Name: 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfanyl]phenyl]imino-1,7-dimethyl-5-nitroindol-2-one Traditional Name: 3-[2-[(3,5-dimethyl-1H-pyrazol-4-yl)thio]phenyl]imino-1,7-dimethyl-5-nitro-oxindole Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=NC3=CC=CC=C3SC4=C(NN=C4C)C)C(=O)N2C

Isomeric SMILES

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=NC3=CC=CC=C3SC4=C(NN=C4C)C)C(=O)N2C

InChI

InChI=1S/C21H19N5O3S/c1-11-9-14(26(28)29)10-15-18(21(27)25(4)19(11)15)22-16-7-5-6-8-17(16)30-20-12(2)23-24-13(20)3/h5-10H,1-4H3,(H,23,24)