4,6-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one

Systemtic Name: 4,6-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one Openeye Name: 4,6-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one CAS Name: 4,6-dimethyl-7-(prop-2-ynylthio)-1-benzopyran-2-one IUPAC Name: 4,6-dimethyl-7-prop-2-ynylsulfanylchromen-2-one Traditional Name: 4,6-dimethyl-7-(propargylthio)coumarin Formula: C14H12O2S MolecularWeight: 244.30888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)C)SCC#C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)C)SCC#C

InChI

InChI=1S/C14H12O2S/c1-4-5-17-13-8-12-11(6-10(13)3)9(2)7-14(15)16-12/h1,6-8H,5H2,2-3H3