N-[4-chloranyl-3-[(E)-(2-methylpropan-2-yl)oxyiminomethyl]phenyl]-1,2-dimethyl-pyrrole-3-carbothioamide

Systemtic Name: N-[4-chloranyl-3-[(E)-(2-methylpropan-2-yl)oxyiminomethyl]phenyl]-1,2-dimethyl-pyrrole-3-carbothioamide Openeye Name: N-[3-[(E)-tert-butoxyiminomethyl]-4-chloro-phenyl]-1,2-dimethyl-pyrrole-3-carbothioamide CAS Name: N-[4-chloro-3-[(E)-(2-methylpropan-2-yl)oxyiminomethyl]phenyl]-1,2-dimethyl-3-pyrrolecarbothioamide IUPAC Name: N-[4-chloro-3-[(E)-(2-methylpropan-2-yl)oxyiminomethyl]phenyl]-1,2-dimethylpyrrole-3-carbothioamide Traditional Name: N-[3-[(E)-tert-butyloximinomethyl]-4-chloro-phenyl]-1,2-dimethyl-pyrrole-3-carbothioamide Formula: C18H22ClN3OS MolecularWeight: 363.90478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN1C)C(=S)NC2=CC(=C(C=C2)Cl)C=NOC(C)(C)C

Isomeric SMILES

CC1=C(C=CN1C)C(=S)NC2=CC(=C(C=C2)Cl)/C=N/OC(C)(C)C

InChI

InChI=1S/C18H22ClN3OS/c1-12-15(8-9-22(12)5)17(24)21-14-6-7-16(19)13(10-14)11-20-23-18(2,3)4/h6-11H,1-5H3,(H,21,24)/b20-11+