1-[(E)-[5-bromanyl-2-(cyanomethoxy)phenyl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[5-bromanyl-2-(cyanomethoxy)phenyl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[5-bromo-2-(cyanomethoxy)phenyl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[5-bromo-2-(cyanomethoxy)phenyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[5-bromo-2-(cyanomethoxy)phenyl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[5-bromo-2-(cyanomethoxy)benzylidene]amino]-3-phenyl-thiourea Formula: C16H13BrN4OS MolecularWeight: 389.26962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NN=CC2=C(C=CC(=C2)Br)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N/N=C/C2=C(C=CC(=C2)Br)OCC#N

InChI

InChI=1S/C16H13BrN4OS/c17-13-6-7-15(22-9-8-18)12(10-13)11-19-21-16(23)20-14-4-2-1-3-5-14/h1-7,10-11H,9H2,(H2,20,21,23)/b19-11+