3-(4-butan-2-ylphenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide

Systemtic Name: 3-(4-butan-2-ylphenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide Openeye Name: N,N-diethyl-3-(4-sec-butylphenyl)sulfanyl-pyrazole-1-carboxamide CAS Name: 3-[(4-butan-2-ylphenyl)thio]-N,N-diethyl-1-pyrazolecarboxamide IUPAC Name: 3-(4-butan-2-ylphenyl)sulfanyl-N,N-diethylpyrazole-1-carboxamide Traditional Name: N,N-diethyl-3-[(4-sec-butylphenyl)thio]pyrazole-1-carboxamide Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)SC2=NN(C=C2)C(=O)N(CC)CC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)SC2=NN(C=C2)C(=O)N(CC)CC

InChI

InChI=1S/C18H25N3OS/c1-5-14(4)15-8-10-16(11-9-15)23-17-12-13-21(19-17)18(22)20(6-2)7-3/h8-14H,5-7H2,1-4H3