1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-oxo-1-pyrrolidinyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]thiourea Traditional Name: 1-[4-(2-ketopyrrolidino)phenyl]-3-piperonyl-thiourea Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N3O3S/c23-18-2-1-9-22(18)15-6-4-14(5-7-15)21-19(26)20-11-13-3-8-16-17(10-13)25-12-24-16/h3-8,10H,1-2,9,11-12H2,(H2,20,21,26)