1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(1-methylbenzimidazol-2-yl)ethanoylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(1-methylbenzimidazol-2-yl)ethanoylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(1-methyl-2-benzimidazolyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]thiourea Traditional Name: 1-[[2-(1-methylbenzimidazol-2-yl)acetyl]amino]-3-piperonyl-thiourea Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CC(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1CC(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N5O3S/c1-24-14-5-3-2-4-13(14)21-17(24)9-18(25)22-23-19(28)20-10-12-6-7-15-16(8-12)27-11-26-15/h2-8H,9-11H2,1H3,(H,22,25)(H2,20,23,28)