ethyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-phenyldiazenylphenyl)carbamimidothioate

Systemtic Name: ethyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-phenyldiazenylphenyl)carbamimidothioate Openeye Name: 2-ethyl-1,1-bis[(4-methoxyphenyl)methyl]-3-(4-phenylazophenyl)isothiourea CAS Name: N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-phenyldiazenylphenyl)carbamimidothioic acid ethyl ester IUPAC Name: ethyl N,N-bis[(4-methoxyphenyl)methyl]-N'-(4-phenyldiazenylphenyl)carbamimidothioate Traditional Name: 2-ethyl-1,1-bis(p-anisyl)-3-(4-phenylazophenyl)isothiourea Formula: C31H32N4O2S MolecularWeight: 524.67638

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=CC=C(C=C1)N=NC2=CC=CC=C2)N(CC3=CC=C(C=C3)OC)CC4=CC=C(C=C4)OC

Isomeric SMILES

CCSC(=NC1=CC=C(C=C1)N=NC2=CC=CC=C2)N(CC3=CC=C(C=C3)OC)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C31H32N4O2S/c1-4-38-31(32-26-14-16-28(17-15-26)34-33-27-8-6-5-7-9-27)35(22-24-10-18-29(36-2)19-11-24)23-25-12-20-30(37-3)21-13-25/h5-21H,4,22-23H2,1-3H3