(phenylmethyl) N-[4-(2-carbazol-9-ylethoxy)phenyl]-N'-ethyl-carbamimidothioate

Systemtic Name: (phenylmethyl) N-[4-(2-carbazol-9-ylethoxy)phenyl]-N'-ethyl-carbamimidothioate Openeye Name: 2-benzyl-1-[4-(2-carbazol-9-ylethoxy)phenyl]-3-ethyl-isothiourea CAS Name: N-[4-[2-(9-carbazolyl)ethoxy]phenyl]-N'-ethylcarbamimidothioic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-(2-carbazol-9-ylethoxy)phenyl]-N'-ethylcarbamimidothioate Traditional Name: 2-benzyl-1-[4-(2-carbazol-9-ylethoxy)phenyl]-3-ethyl-isothiourea Formula: C30H29N3OS MolecularWeight: 479.63576

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC1=CC=C(C=C1)OCCN2C3=CC=CC=C3C4=CC=CC=C42)SCC5=CC=CC=C5

Isomeric SMILES

CCN=C(NC1=CC=C(C=C1)OCCN2C3=CC=CC=C3C4=CC=CC=C42)SCC5=CC=CC=C5

InChI

InChI=1S/C30H29N3OS/c1-2-31-30(35-22-23-10-4-3-5-11-23)32-24-16-18-25(19-17-24)34-21-20-33-28-14-8-6-12-26(28)27-13-7-9-15-29(27)33/h3-19H,2,20-22H2,1H3,(H,31,32)