4,8-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one

Systemtic Name: 4,8-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one Openeye Name: 4,8-dimethyl-7-prop-2-ynylsulfanyl-chromen-2-one CAS Name: 4,8-dimethyl-7-(prop-2-ynylthio)-1-benzopyran-2-one IUPAC Name: 4,8-dimethyl-7-prop-2-ynylsulfanylchromen-2-one Traditional Name: 4,8-dimethyl-7-(propargylthio)coumarin Formula: C14H12O2S MolecularWeight: 244.30888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)SCC#C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)SCC#C

InChI

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