S-[2-ethyl-1-(phenylmethyl)-6-propan-2-yl-indol-5-yl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-ethyl-1-(phenylmethyl)-6-propan-2-yl-indol-5-yl] N,N-dimethylcarbamothioate Openeye Name: S-(1-benzyl-2-ethyl-6-isopropyl-indol-5-yl) N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[[2-ethyl-1-(phenylmethyl)-6-propan-2-yl-5-indolyl]] ester IUPAC Name: S-(1-benzyl-2-ethyl-6-propan-2-ylindol-5-yl) N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-(1-benzyl-2-ethyl-6-isopropyl-indol-5-yl) ester Formula: C23H28N2OS MolecularWeight: 380.54622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=CC(=C(C=C2N1CC3=CC=CC=C3)C(C)C)SC(=O)N(C)C

Isomeric SMILES

CCC1=CC2=CC(=C(C=C2N1CC3=CC=CC=C3)C(C)C)SC(=O)N(C)C

InChI

InChI=1S/C23H28N2OS/c1-6-19-12-18-13-22(27-23(26)24(4)5)20(16(2)3)14-21(18)25(19)15-17-10-8-7-9-11-17/h7-14,16H,6,15H2,1-5H3