ethyl 3-[[2-[2-(2-methyl-1H-indol-3-yl)ethanoyl]pyrazolidin-1-yl]carbothioylamino]propanoate

Systemtic Name: ethyl 3-[[2-[2-(2-methyl-1H-indol-3-yl)ethanoyl]pyrazolidin-1-yl]carbothioylamino]propanoate Openeye Name: ethyl 3-[[2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioyl]amino]propanoate CAS Name: 3-[[[2-[2-(2-methyl-1H-indol-3-yl)-1-oxoethyl]-1-pyrazolidinyl]-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioyl]amino]propanoate Traditional Name: 3-[[2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioyl]amino]propionic acid ethyl ester Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=S)N1CCCN1C(=O)CC2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)CCNC(=S)N1CCCN1C(=O)CC2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C20H26N4O3S/c1-3-27-19(26)9-10-21-20(28)24-12-6-11-23(24)18(25)13-16-14(2)22-17-8-5-4-7-15(16)17/h4-5,7-8,22H,3,6,9-13H2,1-2H3,(H,21,28)