4-(1,3-benzodioxol-5-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: 4-(1,3-benzodioxol-5-yl)-N-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(1,3-benzodioxol-5-yl)-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C17H19N3O3S/c24-17(18-11-14-2-1-9-21-14)20-7-5-19(6-8-20)13-3-4-15-16(10-13)23-12-22-15/h1-4,9-10H,5-8,11-12H2,(H,18,24)