(phenylmethyl) N-[2-[5-(2-azanyl-2-sulfanylidene-ethyl)-1H-indol-3-yl]ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[5-(2-azanyl-2-sulfanylidene-ethyl)-1H-indol-3-yl]ethyl]carbamate Openeye Name: benzyl N-[2-[5-(2-amino-2-thioxo-ethyl)-1H-indol-3-yl]ethyl]carbamate CAS Name: N-[2-[5-(2-amino-2-sulfanylideneethyl)-1H-indol-3-yl]ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[5-(2-amino-2-sulfanylideneethyl)-1H-indol-3-yl]ethyl]carbamate Traditional Name: N-[2-[5-(2-amino-2-thioxo-ethyl)-1H-indol-3-yl]ethyl]carbamic acid benzyl ester Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCC2=CNC3=C2C=C(C=C3)CC(=S)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCC2=CNC3=C2C=C(C=C3)CC(=S)N

InChI

InChI=1S/C20H21N3O2S/c21-19(26)11-15-6-7-18-17(10-15)16(12-23-18)8-9-22-20(24)25-13-14-4-2-1-3-5-14/h1-7,10,12,23H,8-9,11,13H2,(H2,21,26)(H,22,24)