N-[4-[(3-cyclohexylpropanoylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[(3-cyclohexylpropanoylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[(3-cyclohexylpropanoylcarbamothioylamino)carbamoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[[(3-cyclohexyl-1-oxopropyl)amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[(3-cyclohexylpropanoylcarbamothioylamino)carbamoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[(3-cyclohexylpropanoylthiocarbamoylamino)carbamoyl]phenyl]-2-methyl-benzamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCC3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCC3CCCCC3

InChI

InChI=1S/C25H30N4O3S/c1-17-7-5-6-10-21(17)24(32)26-20-14-12-19(13-15-20)23(31)28-29-25(33)27-22(30)16-11-18-8-3-2-4-9-18/h5-7,10,12-15,18H,2-4,8-9,11,16H2,1H3,(H,26,32)(H,28,31)(H2,27,29,30,33)