N-[(E)-(5-bromanyl-2-oxidanylidene-1-prop-2-ynyl-indol-3-ylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(5-bromanyl-2-oxidanylidene-1-prop-2-ynyl-indol-3-ylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide Openeye Name: N-[(E)-(5-bromo-2-oxo-1-prop-2-ynyl-indolin-3-ylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide CAS Name: N-[(E)-(5-bromo-2-oxo-1-prop-2-ynyl-3-indolylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(E)-(5-bromo-2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide Traditional Name: N-[(E)-(5-bromo-2-keto-1-propargyl-indolin-3-ylidene)amino]-5-tert-butyl-1H-pyrazole-3-carboxamide Formula: C19H18BrN5O2 MolecularWeight: 428.28252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)C(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC#C

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)C(=O)N/N=C/2\C3=C(C=CC(=C3)Br)N(C2=O)CC#C

InChI

InChI=1S/C19H18BrN5O2/c1-5-8-25-14-7-6-11(20)9-12(14)16(18(25)27)23-24-17(26)13-10-15(22-21-13)19(2,3)4/h1,6-7,9-10H,8H2,2-4H3,(H,21,22)(H,24,26)/b23-16+