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4-(5-methyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide

4-(5-methyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide

Systemtic Name:4-(5-methyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(2-oxidanyl-1-phenyl-ethyl)-1H-pyrrole-2-carboxamide
Openeye Name:N-(2-hydroxy-1-phenyl-ethyl)-4-(5-methyl-2-thioxo-1H-pyrimidin-6-yl)-1H-pyrrole-2-carboxamide
CAS Name:N-(2-hydroxy-1-phenylethyl)-4-(5-methyl-2-sulfanylidene-1H-pyrimidin-6-yl)-1H-pyrrole-2-carboxamide
IUPAC Name:N-(2-hydroxy-1-phenylethyl)-4-(5-methyl-2-sulfanylidene-1H-pyrimidin-6-yl)-1H-pyrrole-2-carboxamide
Traditional Name:N-(2-hydroxy-1-phenyl-ethyl)-4-(5-methyl-2-thioxo-1H-pyrimidin-6-yl)-1H-pyrrole-2-carboxamide
Formula: C18H18N4O2S
MolecularWeight: 354.42612
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=S)N=C1)C2=CNC(=C2)C(=O)NC(CO)C3=CC=CC=C3


Isomeric SMILES

CC1=C(NC(=S)N=C1)C2=CNC(=C2)C(=O)NC(CO)C3=CC=CC=C3


InChI

InChI=1S/C18H18N4O2S/c1-11-8-20-18(25)22-16(11)13-7-14(19-9-13)17(24)21-15(10-23)12-5-3-2-4-6-12/h2-9,15,19,23H,10H2,1H3,(H,21,24)(H,20,22,25)


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