3-[4-(4-hydroxyphenyl)piperazin-1-yl]thiochromen-4-one

Systemtic Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]thiochromen-4-one Openeye Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]thiochromen-4-one CAS Name: 3-[4-(4-hydroxyphenyl)-1-piperazinyl]-1-benzothiopyran-4-one IUPAC Name: 3-[4-(4-hydroxyphenyl)piperazin-1-yl]thiochromen-4-one Traditional Name: 3-[4-(4-hydroxyphenyl)piperazino]thiochromen-4-one Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C3=CSC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C3=CSC4=CC=CC=C4C3=O

InChI

InChI=1S/C19H18N2O2S/c22-15-7-5-14(6-8-15)20-9-11-21(12-10-20)17-13-24-18-4-2-1-3-16(18)19(17)23/h1-8,13,22H,9-12H2