N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)O)C(=S)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)O)C(=S)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H19N3O3S/c22-15-3-1-2-14(11-15)20-6-8-21(9-7-20)18(25)19-13-4-5-16-17(10-13)24-12-23-16/h1-5,10-11,22H,6-9,12H2,(H,19,25)