1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(2-methoxyethyl)thiourea

Systemtic Name: 1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(2-methoxyethyl)thiourea Openeye Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(2-methoxyethyl)thiourea CAS Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(2-methoxyethyl)thiourea IUPAC Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(2-methoxyethyl)thiourea Traditional Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(2-methoxyethyl)thiourea Formula: C12H14BrN3O3S MolecularWeight: 360.22686

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NN=CC1=CC2=C(C(=C1)Br)OCO2

Isomeric SMILES

COCCNC(=S)N/N=C\C1=CC2=C(C(=C1)Br)OCO2

InChI

InChI=1S/C12H14BrN3O3S/c1-17-3-2-14-12(20)16-15-6-8-4-9(13)11-10(5-8)18-7-19-11/h4-6H,2-3,7H2,1H3,(H2,14,16,20)/b15-6-