N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-ethyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxidanylidene-ethyl]-N-ethyl-thiophene-2-carboxamide Openeye Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexyl-amino]-2-oxo-ethyl]-N-ethyl-thiophene-2-carboxamide CAS Name: N-[2-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl-cyclohexylamino]-2-oxoethyl]-N-ethyl-2-thiophenecarboxamide IUPAC Name: N-[2-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl-cyclohexylamino]-2-oxoethyl]-N-ethylthiophene-2-carboxamide Traditional Name: N-[2-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl-cyclohexyl-amino]-2-keto-ethyl]-N-ethyl-thiophene-2-carboxamide Formula: C27H32ClN3O2S MolecularWeight: 498.07988

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C4=CC=CS4

Isomeric SMILES

CCN(CC(=O)N(CC1=CC=CN1CC2=CC=CC=C2Cl)C3CCCCC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C27H32ClN3O2S/c1-2-29(27(33)25-15-9-17-34-25)20-26(32)31(22-11-4-3-5-12-22)19-23-13-8-16-30(23)18-21-10-6-7-14-24(21)28/h6-10,13-17,22H,2-5,11-12,18-20H2,1H3