N-[4-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide Openeye Name: N-[4-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbenzamide IUPAC Name: N-[4-(3-cyclohexylpropanoylcarbamothioylamino)phenyl]-3-methylbenzamide Traditional Name: N-[4-(3-cyclohexylpropanoylthiocarbamoylamino)phenyl]-3-methyl-benzamide Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C24H29N3O2S/c1-17-6-5-9-19(16-17)23(29)25-20-11-13-21(14-12-20)26-24(30)27-22(28)15-10-18-7-3-2-4-8-18/h5-6,9,11-14,16,18H,2-4,7-8,10,15H2,1H3,(H,25,29)(H2,26,27,28,30)