7-chloranyl-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]thiochromen-4-one

Systemtic Name: 7-chloranyl-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]thiochromen-4-one Openeye Name: 7-chloro-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]thiochromen-4-one CAS Name: 7-chloro-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]-1-benzothiopyran-4-one IUPAC Name: 7-chloro-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]thiochromen-4-one Traditional Name: 7-chloro-2-[4-(4-methylphenoxy)but-2-ynylsulfinyl]thiochromen-4-one Formula: C20H15ClO3S2 MolecularWeight: 402.9143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC#CCS(=O)C2=CC(=O)C3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)OCC#CCS(=O)C2=CC(=O)C3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C20H15ClO3S2/c1-14-4-7-16(8-5-14)24-10-2-3-11-26(23)20-13-18(22)17-9-6-15(21)12-19(17)25-20/h4-9,12-13H,10-11H2,1H3