N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-[3-methoxypropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]ethanamide

Systemtic Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-[3-methoxypropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]ethanamide Openeye Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-[3-methoxypropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]acetamide CAS Name: N-[5-tert-butyl-2-(2-methylphenyl)-3-pyrazolyl]-2-[3-methoxypropyl-[[4-(methylthio)anilino]-oxomethyl]amino]acetamide IUPAC Name: N-[5-tert-butyl-2-(2-methylphenyl)pyrazol-3-yl]-2-[3-methoxypropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]acetamide Traditional Name: N-[5-tert-butyl-2-(o-tolyl)pyrazol-3-yl]-2-[3-methoxypropyl-[[4-(methylthio)phenyl]carbamoyl]amino]acetamide Formula: C28H37N5O3S MolecularWeight: 523.69008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCCOC)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C(C)(C)C)NC(=O)CN(CCCOC)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C28H37N5O3S/c1-20-10-7-8-11-23(20)33-25(18-24(31-33)28(2,3)4)30-26(34)19-32(16-9-17-36-5)27(35)29-21-12-14-22(37-6)15-13-21/h7-8,10-15,18H,9,16-17,19H2,1-6H3,(H,29,35)(H,30,34)