1-methyl-N-[(3-phenylmethoxyphenyl)carbamothioyl]pyrrole-2-carboxamide

Systemtic Name: 1-methyl-N-[(3-phenylmethoxyphenyl)carbamothioyl]pyrrole-2-carboxamide Openeye Name: N-[(3-benzyloxyphenyl)carbamothioyl]-1-methyl-pyrrole-2-carboxamide CAS Name: 1-methyl-N-[(3-phenylmethoxyanilino)-sulfanylidenemethyl]-2-pyrrolecarboxamide IUPAC Name: 1-methyl-N-[(3-phenylmethoxyphenyl)carbamothioyl]pyrrole-2-carboxamide Traditional Name: N-[(3-benzoxyphenyl)thiocarbamoyl]-1-methyl-pyrrole-2-carboxamide Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=S)NC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=S)NC2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O2S/c1-23-12-6-11-18(23)19(24)22-20(26)21-16-9-5-10-17(13-16)25-14-15-7-3-2-4-8-15/h2-13H,14H2,1H3,(H2,21,22,24,26)