N-(4-methoxyphenyl)-4-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]benzamide Openeye Name: N-(4-methoxyphenyl)-4-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]benzamide CAS Name: N-(4-methoxyphenyl)-4-[[[[(1S,2S)-2-methylcyclohexyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]benzamide Traditional Name: N-(4-methoxyphenyl)-4-[[(1S,2S)-2-methylcyclohexyl]thiocarbamoylamino]benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O2S/c1-15-5-3-4-6-20(15)25-22(28)24-18-9-7-16(8-10-18)21(26)23-17-11-13-19(27-2)14-12-17/h7-15,20H,3-6H2,1-2H3,(H,23,26)(H2,24,25,28)/t15-,20-/m0/s1