3-phenylsulfanylpropanethioyl 5-azanyl-1H-indole-2-carboxylate

Systemtic Name: 3-phenylsulfanylpropanethioyl 5-azanyl-1H-indole-2-carboxylate Openeye Name: 3-phenylsulfanylpropanethioyl 5-amino-1H-indole-2-carboxylate CAS Name: 5-amino-1H-indole-2-carboxylic acid [3-(phenylthio)-1-sulfanylidenepropyl] ester IUPAC Name: 3-phenylsulfanylpropanethioyl 5-amino-1H-indole-2-carboxylate Traditional Name: 5-amino-1H-indole-2-carboxylic acid 3-(phenylthio)propanethioyl ester Formula: C18H16N2O2S2 MolecularWeight: 356.46184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=S)OC(=O)C2=CC3=C(N2)C=CC(=C3)N

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=S)OC(=O)C2=CC3=C(N2)C=CC(=C3)N

InChI

InChI=1S/C18H16N2O2S2/c19-13-6-7-15-12(10-13)11-16(20-15)18(21)22-17(23)8-9-24-14-4-2-1-3-5-14/h1-7,10-11,20H,8-9,19H2