methyl N,N'-bis[(E)-1-(4-bromophenyl)ethylideneamino]carbamimidothioate

Systemtic Name: methyl N,N'-bis[(E)-1-(4-bromophenyl)ethylideneamino]carbamimidothioate Openeye Name: 1,3-bis[(E)-1-(4-bromophenyl)ethylideneamino]-2-methyl-isothiourea CAS Name: N,N'-bis[(E)-1-(4-bromophenyl)ethylideneamino]carbamimidothioic acid methyl ester IUPAC Name: methyl N,N'-bis[(E)-1-(4-bromophenyl)ethylideneamino]carbamimidothioate Traditional Name: 1,3-bis[(E)-1-(4-bromophenyl)ethylideneamino]-2-methyl-isothiourea Formula: C18H18Br2N4S MolecularWeight: 482.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=NN=C(C)C1=CC=C(C=C1)Br)SC)C2=CC=C(C=C2)Br

Isomeric SMILES

C/C(=N\N/C(=N\N=C(/C)\C1=CC=C(C=C1)Br)/SC)/C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18Br2N4S/c1-12(14-4-8-16(19)9-5-14)21-23-18(25-3)24-22-13(2)15-6-10-17(20)11-7-15/h4-11H,1-3H3,(H,23,24)/b21-12+,22-13+