methyl 3-(4-aminophenyl)-2-[[1-(2-methoxyethyl)cyclopentyl]carbothioylamino]propanoate

Systemtic Name: methyl 3-(4-aminophenyl)-2-[[1-(2-methoxyethyl)cyclopentyl]carbothioylamino]propanoate Openeye Name: methyl 3-(4-aminophenyl)-2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]propanoate CAS Name: 3-(4-aminophenyl)-2-[[[1-(2-methoxyethyl)cyclopentyl]-sulfanylidenemethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-aminophenyl)-2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]propanoate Traditional Name: 3-(4-aminophenyl)-2-[[1-(2-methoxyethyl)cyclopentanecarbothioyl]amino]propionic acid methyl ester Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1(CCCC1)C(=S)NC(CC2=CC=C(C=C2)N)C(=O)OC

Isomeric SMILES

COCCC1(CCCC1)C(=S)NC(CC2=CC=C(C=C2)N)C(=O)OC

InChI

InChI=1S/C19H28N2O3S/c1-23-12-11-19(9-3-4-10-19)18(25)21-16(17(22)24-2)13-14-5-7-15(20)8-6-14/h5-8,16H,3-4,9-13,20H2,1-2H3,(H,21,25)