methyl 2-methyl-4-(2-phenylethanethioylamino)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-4-(2-phenylethanethioylamino)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-methyl-4-[(2-phenylethanethioyl)amino]-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-4-[(2-phenyl-1-sulfanylideneethyl)amino]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-4-[(2-phenylethanethioyl)amino]-1H-pyrrole-3-carboxylate Traditional Name: 2-methyl-4-[(2-phenylthioacetyl)amino]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1)NC(=S)CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=CN1)NC(=S)CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H16N2O2S/c1-10-14(15(18)19-2)12(9-16-10)17-13(20)8-11-6-4-3-5-7-11/h3-7,9,16H,8H2,1-2H3,(H,17,20)