6-methoxy-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiochromen-4-one

Systemtic Name: 6-methoxy-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiochromen-4-one Openeye Name: 6-methoxy-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiochromen-4-one CAS Name: 6-methoxy-3-[4-(4-methoxyphenyl)-1-piperazinyl]-1-benzothiopyran-4-one IUPAC Name: 6-methoxy-3-[4-(4-methoxyphenyl)piperazin-1-yl]thiochromen-4-one Traditional Name: 6-methoxy-3-[4-(4-methoxyphenyl)piperazino]thiochromen-4-one Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=CSC4=C(C3=O)C=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=CSC4=C(C3=O)C=C(C=C4)OC

InChI

InChI=1S/C21H22N2O3S/c1-25-16-5-3-15(4-6-16)22-9-11-23(12-10-22)19-14-27-20-8-7-17(26-2)13-18(20)21(19)24/h3-8,13-14H,9-12H2,1-2H3