N-[4-chloranyl-3-[(E)-prop-2-ynoxyiminomethyl]phenyl]-2-methyl-furan-3-carbothioamide

Systemtic Name: N-[4-chloranyl-3-[(E)-prop-2-ynoxyiminomethyl]phenyl]-2-methyl-furan-3-carbothioamide Openeye Name: N-[4-chloro-3-[(E)-prop-2-ynoxyiminomethyl]phenyl]-2-methyl-furan-3-carbothioamide CAS Name: N-[4-chloro-3-[(E)-prop-2-ynoxyiminomethyl]phenyl]-2-methyl-3-furancarbothioamide IUPAC Name: N-[4-chloro-3-[(E)-prop-2-ynoxyiminomethyl]phenyl]-2-methylfuran-3-carbothioamide Traditional Name: N-[4-chloro-3-[(E)-propargyloximinomethyl]phenyl]-2-methyl-furan-3-carbothioamide Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C=NOCC#C

Isomeric SMILES

CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)/C=N/OCC#C

InChI

InChI=1S/C16H13ClN2O2S/c1-3-7-21-18-10-12-9-13(4-5-15(12)17)19-16(22)14-6-8-20-11(14)2/h1,4-6,8-10H,7H2,2H3,(H,19,22)/b18-10+