1-(1,3-benzodioxol-5-ylmethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-furylmethyl)-1-(3-pyridylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-furanylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(furan-2-ylmethyl)-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-(2-furfuryl)-1-piperonyl-1-(3-pyridylmethyl)thiourea Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN(CC3=CN=CC=C3)C(=S)NCC4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN(CC3=CN=CC=C3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C20H19N3O3S/c27-20(22-11-17-4-2-8-24-17)23(13-16-3-1-7-21-10-16)12-15-5-6-18-19(9-15)26-14-25-18/h1-10H,11-14H2,(H,22,27)