ethyl 3-azanyl-2-(phenylcarbamothioyl)-3-pyrrolidin-1-yl-prop-2-enoate

Systemtic Name: ethyl 3-azanyl-2-(phenylcarbamothioyl)-3-pyrrolidin-1-yl-prop-2-enoate Openeye Name: ethyl 3-amino-2-(phenylcarbamothioyl)-3-pyrrolidin-1-yl-prop-2-enoate CAS Name: 3-amino-2-[anilino(sulfanylidene)methyl]-3-(1-pyrrolidinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-(phenylcarbamothioyl)-3-pyrrolidin-1-ylprop-2-enoate Traditional Name: 3-amino-2-(phenylthiocarbamoyl)-3-pyrrolidino-acrylic acid ethyl ester Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N)N1CCCC1)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(=C(N)N1CCCC1)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2S/c1-2-21-16(20)13(14(17)19-10-6-7-11-19)15(22)18-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11,17H2,1H3,(H,18,22)