1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butyl-thiourea

Systemtic Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butyl-thiourea Openeye Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butyl-thiourea CAS Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butylthiourea IUPAC Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butylthiourea Traditional Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-3-butyl-thiourea Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C(C)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCNC(=S)N/N=C(\C)/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H19N3O2S/c1-3-4-7-15-14(20)17-16-10(2)11-5-6-12-13(8-11)19-9-18-12/h5-6,8H,3-4,7,9H2,1-2H3,(H2,15,17,20)/b16-10+