N-[4-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoylamino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanoylamino]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[[2-[1-(o-tolyl)imidazol-2-yl]sulfanylacetyl]amino]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[[2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-1-oxoethyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[[2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetyl]amino]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[2-[[1-(o-tolyl)imidazol-2-yl]thio]acetyl]amino]phenyl]cyclopropanecarboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)NC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H22N4O2S/c1-15-4-2-3-5-19(15)26-13-12-23-22(26)29-14-20(27)24-17-8-10-18(11-9-17)25-21(28)16-6-7-16/h2-5,8-13,16H,6-7,14H2,1H3,(H,24,27)(H,25,28)