2-[[cyclohexyl-[(4-methylphenyl)methyl]carbamothioyl]amino]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[[cyclohexyl-[(4-methylphenyl)methyl]carbamothioyl]amino]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[[cyclohexyl(p-tolylmethyl)carbamothioyl]amino]-N-(2-furylmethyl)acetamide CAS Name: 2-[[[cyclohexyl-[(4-methylphenyl)methyl]amino]-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[[cyclohexyl-[(4-methylphenyl)methyl]carbamothioyl]amino]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[[cyclohexyl-(4-methylbenzyl)thiocarbamoyl]amino]-N-(2-furfuryl)acetamide Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2CCCCC2)C(=S)NCC(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2CCCCC2)C(=S)NCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H29N3O2S/c1-17-9-11-18(12-10-17)16-25(19-6-3-2-4-7-19)22(28)24-15-21(26)23-14-20-8-5-13-27-20/h5,8-13,19H,2-4,6-7,14-16H2,1H3,(H,23,26)(H,24,28)