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

Systemtic Name: 1-[(Z)-(7-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]thiourea CAS Name: 1-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methylideneamino]thiourea Traditional Name: 1-benzyl-3-[(Z)-(7-bromo-1,3-benzodioxol-5-yl)methyleneamino]thiourea Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=NNC(=S)NCC3=CC=CC=C3)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=N\NC(=S)NCC3=CC=CC=C3)Br

InChI

InChI=1S/C16H14BrN3O2S/c17-13-6-12(7-14-15(13)22-10-21-14)9-19-20-16(23)18-8-11-4-2-1-3-5-11/h1-7,9H,8,10H2,(H2,18,20,23)/b19-9-