4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzenecarbothioamide

Systemtic Name: 4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzenecarbothioamide Openeye Name: 4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzenecarbothioamide CAS Name: 4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzenecarbothioamide IUPAC Name: 4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]benzenecarbothioamide Traditional Name: 4-tert-butyl-N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]thiobenzamide Formula: C28H30N2OS MolecularWeight: 442.6156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=S)NCC(C2=CC=C(C=C2)OC)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=S)NCC(C2=CC=C(C=C2)OC)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C28H30N2OS/c1-28(2,3)21-13-9-20(10-14-21)27(32)30-17-24(19-11-15-22(31-4)16-12-19)25-18-29-26-8-6-5-7-23(25)26/h5-16,18,24,29H,17H2,1-4H3,(H,30,32)