N-[(E)-(1-butyl-2-oxidanylidene-indol-3-ylidene)amino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(E)-(1-butyl-2-oxidanylidene-indol-3-ylidene)amino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(E)-(1-butyl-2-oxo-indolin-3-ylidene)amino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(E)-(1-butyl-2-oxo-3-indolylidene)amino]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[(E)-(1-butyl-2-oxoindol-3-ylidene)amino]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[(E)-(1-butyl-2-keto-indolin-3-ylidene)amino]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=NNC(=O)CSC3=NC(=CC(=N3)C)C)C1=O

Isomeric SMILES

CCCCN1C2=CC=CC=C2/C(=N\NC(=O)CSC3=NC(=CC(=N3)C)C)/C1=O

InChI

InChI=1S/C20H23N5O2S/c1-4-5-10-25-16-9-7-6-8-15(16)18(19(25)27)24-23-17(26)12-28-20-21-13(2)11-14(3)22-20/h6-9,11H,4-5,10,12H2,1-3H3,(H,23,26)/b24-18+