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

Systemtic Name: methyl N'-[4-(2-carbazol-9-ylethoxy)phenyl]carbamimidothioate Openeye Name: 3-[4-(2-carbazol-9-ylethoxy)phenyl]-2-methyl-isothiourea CAS Name: N'-[4-[2-(9-carbazolyl)ethoxy]phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[4-(2-carbazol-9-ylethoxy)phenyl]carbamimidothioate Traditional Name: 3-[4-(2-carbazol-9-ylethoxy)phenyl]-2-methyl-isothiourea Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=C(C=C1)OCCN2C3=CC=CC=C3C4=CC=CC=C42)N

Isomeric SMILES

CSC(=NC1=CC=C(C=C1)OCCN2C3=CC=CC=C3C4=CC=CC=C42)N

InChI

InChI=1S/C22H21N3OS/c1-27-22(23)24-16-10-12-17(13-11-16)26-15-14-25-20-8-4-2-6-18(20)19-7-3-5-9-21(19)25/h2-13H,14-15H2,1H3,(H2,23,24)