N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-formyl-piperazine-1-carbothioamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=S)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CN(CCN1C=O)C(=S)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H17N3O3S/c18-10-16-3-5-17(6-4-16)14(21)15-11-1-2-12-13(9-11)20-8-7-19-12/h1-2,9-10H,3-8H2,(H,15,21)