2-[cyclohexyl-[(phenylmethyl)carbamoyl]amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[cyclohexyl-[(phenylmethyl)carbamoyl]amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[benzylcarbamoyl(cyclohexyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[cyclohexyl-[oxo-[(phenylmethyl)amino]methyl]amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[benzylcarbamoyl(cyclohexyl)amino]-N-[(4-fluorophenyl)methyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[benzylcarbamoyl(cyclohexyl)amino]-N-(4-fluorobenzyl)-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C29H34FN3O2S MolecularWeight: 507.662563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(C3CCCCC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)CN(C3CCCCC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C29H34FN3O2S/c1-22-16-17-36-27(22)20-32(19-24-12-14-25(30)15-13-24)28(34)21-33(26-10-6-3-7-11-26)29(35)31-18-23-8-4-2-5-9-23/h2,4-5,8-9,12-17,26H,3,6-7,10-11,18-21H2,1H3,(H,31,35)