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

Systemtic Name: 1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]-3-(3-methoxyphenyl)thiourea Formula: C16H14BrN3O3S MolecularWeight: 408.26966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NN=CC2=CC3=C(C(=C2)Br)OCO3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N/N=C\C2=CC3=C(C(=C2)Br)OCO3

InChI

InChI=1S/C16H14BrN3O3S/c1-21-12-4-2-3-11(7-12)19-16(24)20-18-8-10-5-13(17)15-14(6-10)22-9-23-15/h2-8H,9H2,1H3,(H2,19,20,24)/b18-8-