methyl 2-(aminomethyl)-3-[(3R)-3-methyl-3-(phenylmethoxycarbonylamino)-2-sulfanylidene-pyrrolidin-1-yl]propanoate

Systemtic Name: methyl 2-(aminomethyl)-3-[(3R)-3-methyl-3-(phenylmethoxycarbonylamino)-2-sulfanylidene-pyrrolidin-1-yl]propanoate Openeye Name: methyl 2-(aminomethyl)-3-[(3R)-3-(benzyloxycarbonylamino)-3-methyl-2-thioxo-pyrrolidin-1-yl]propanoate CAS Name: 2-(aminomethyl)-3-[(3R)-3-methyl-3-(phenylmethoxycarbonylamino)-2-sulfanylidene-1-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl 2-(aminomethyl)-3-[(3R)-3-methyl-3-(phenylmethoxycarbonylamino)-2-sulfanylidenepyrrolidin-1-yl]propanoate Traditional Name: 2-(aminomethyl)-3-[(3R)-3-(benzyloxycarbonylamino)-3-methyl-2-thioxo-pyrrolidino]propionic acid methyl ester Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C1=S)CC(CN)C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@]1(CCN(C1=S)CC(CN)C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O4S/c1-18(20-17(23)25-12-13-6-4-3-5-7-13)8-9-21(16(18)26)11-14(10-19)15(22)24-2/h3-7,14H,8-12,19H2,1-2H3,(H,20,23)/t14?,18-/m1/s1