cyclopenten-1-ylmethyl 2-(ethoxycarbonylcarbamothioylamino)-2-phenyl-ethanoate

Systemtic Name: cyclopenten-1-ylmethyl 2-(ethoxycarbonylcarbamothioylamino)-2-phenyl-ethanoate Openeye Name: cyclopenten-1-ylmethyl 2-(ethoxycarbonylcarbamothioylamino)-2-phenyl-acetate CAS Name: 2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-2-phenylacetic acid 1-cyclopentenylmethyl ester IUPAC Name: cyclopenten-1-ylmethyl 2-(ethoxycarbonylcarbamothioylamino)-2-phenylacetate Traditional Name: 2-(carbethoxythiocarbamoylamino)-2-phenyl-acetic acid cyclopenten-1-ylmethyl ester Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC(C1=CC=CC=C1)C(=O)OCC2=CCCC2

Isomeric SMILES

CCOC(=O)NC(=S)NC(C1=CC=CC=C1)C(=O)OCC2=CCCC2

InChI

InChI=1S/C18H22N2O4S/c1-2-23-18(22)20-17(25)19-15(14-10-4-3-5-11-14)16(21)24-12-13-8-6-7-9-13/h3-5,8,10-11,15H,2,6-7,9,12H2,1H3,(H2,19,20,22,25)