N-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]-4-methoxy-benzamide

Systemtic Name: N-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]-4-methoxy-benzamide Openeye Name: N-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]-4-methoxy-benzamide CAS Name: N-[4-[[[(cyclohexylamino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-4-methoxybenzamide IUPAC Name: N-[4-[(cyclohexylcarbamothioylamino)carbamoyl]phenyl]-4-methoxybenzamide Traditional Name: N-[4-[(cyclohexylthiocarbamoylamino)carbamoyl]phenyl]-4-methoxy-benzamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC3CCCCC3

InChI

InChI=1S/C22H26N4O3S/c1-29-19-13-9-15(10-14-19)20(27)23-18-11-7-16(8-12-18)21(28)25-26-22(30)24-17-5-3-2-4-6-17/h7-14,17H,2-6H2,1H3,(H,23,27)(H,25,28)(H2,24,26,30)