N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-oxo-1-(p-tolyl)ethyl]thiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-1-(4-methylphenyl)-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-[2-(cyclohexylamino)-2-keto-1-(p-tolyl)ethyl]thiophene-2-carboxamide Formula: C27H28N2O4S MolecularWeight: 476.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H28N2O4S/c1-18-9-11-19(12-10-18)25(26(30)28-20-6-3-2-4-7-20)29(27(31)24-8-5-15-34-24)21-13-14-22-23(16-21)33-17-32-22/h5,8-16,20,25H,2-4,6-7,17H2,1H3,(H,28,30)