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

Systemtic Name: N-[(5-bromanyl-2-oxidanylidene-1-prop-2-ynyl-indol-3-ylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide Openeye Name: N-[(5-bromo-2-oxo-1-prop-2-ynyl-indolin-3-ylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide CAS Name: N-[(5-bromo-2-oxo-1-prop-2-ynyl-3-indolylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide IUPAC Name: N-[(5-bromo-2-oxo-1-prop-2-ynylindol-3-ylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide Traditional Name: N-[(5-bromo-2-keto-1-propargyl-indolin-3-ylidene)amino]-5-methyl-1H-pyrazole-3-carboxamide Formula: C16H12BrN5O2 MolecularWeight: 386.20278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC#C

Isomeric SMILES

CC1=CC(=NN1)C(=O)NN=C2C3=C(C=CC(=C3)Br)N(C2=O)CC#C

InChI

InChI=1S/C16H12BrN5O2/c1-3-6-22-13-5-4-10(17)8-11(13)14(16(22)24)20-21-15(23)12-7-9(2)18-19-12/h1,4-5,7-8H,6H2,2H3,(H,18,19)(H,21,23)