S-(2-azanylethyl) 2-[(4-hydroxyphenyl)carbamoyl]pyrrolidine-1-carbothioate

Systemtic Name: S-(2-azanylethyl) 2-[(4-hydroxyphenyl)carbamoyl]pyrrolidine-1-carbothioate Openeye Name: S-(2-aminoethyl) 2-[(4-hydroxyphenyl)carbamoyl]pyrrolidine-1-carbothioate CAS Name: 2-[(4-hydroxyanilino)-oxomethyl]-1-pyrrolidinecarbothioic acid S-(2-aminoethyl) ester IUPAC Name: S-(2-aminoethyl) 2-[(4-hydroxyphenyl)carbamoyl]pyrrolidine-1-carbothioate Traditional Name: 2-[(4-hydroxyphenyl)carbamoyl]pyrrolidine-1-carbothioic acid S-(2-aminoethyl) ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)SCCN)C(=O)NC2=CC=C(C=C2)O

Isomeric SMILES

C1CC(N(C1)C(=O)SCCN)C(=O)NC2=CC=C(C=C2)O

InChI

InChI=1S/C14H19N3O3S/c15-7-9-21-14(20)17-8-1-2-12(17)13(19)16-10-3-5-11(18)6-4-10/h3-6,12,18H,1-2,7-9,15H2,(H,16,19)