N-(2-chloranyl-6-methyl-phenyl)-N-prop-2-ynyl-propanethioamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-N-prop-2-ynyl-propanethioamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-N-prop-2-ynyl-propanethioamide CAS Name: N-(2-chloro-6-methylphenyl)-N-prop-2-ynylpropanethioamide IUPAC Name: N-(2-chloro-6-methylphenyl)-N-prop-2-ynylpropanethioamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-N-propargyl-thiopropionamide Formula: C13H14ClNS MolecularWeight: 251.77496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=S)N(CC#C)C1=C(C=CC=C1Cl)C

Isomeric SMILES

CCC(=S)N(CC#C)C1=C(C=CC=C1Cl)C

InChI

InChI=1S/C13H14ClNS/c1-4-9-15(12(16)5-2)13-10(3)7-6-8-11(13)14/h1,6-8H,5,9H2,2-3H3