N-(4-cyclopentylsulfanylphenyl)-3-(propan-2-ylcarbamoylamino)benzamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-3-(propan-2-ylcarbamoylamino)benzamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-3-(isopropylcarbamoylamino)benzamide CAS Name: N-[4-(cyclopentylthio)phenyl]-3-[[oxo-(propan-2-ylamino)methyl]amino]benzamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-3-(propan-2-ylcarbamoylamino)benzamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-3-(isopropylcarbamoylamino)benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SC3CCCC3

Isomeric SMILES

CC(C)NC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)SC3CCCC3

InChI

InChI=1S/C22H27N3O2S/c1-15(2)23-22(27)25-18-7-5-6-16(14-18)21(26)24-17-10-12-20(13-11-17)28-19-8-3-4-9-19/h5-7,10-15,19H,3-4,8-9H2,1-2H3,(H,24,26)(H2,23,25,27)