N-[2-azanyl-1-cyclohexyl-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-(1,3-benzodioxol-5-yl)thiophene-2-carboxamide

Systemtic Name: N-[2-azanyl-1-cyclohexyl-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-(1,3-benzodioxol-5-yl)thiophene-2-carboxamide Openeye Name: N-[2-amino-1-cyclohexyl-1-(3-methoxyphenyl)-2-oxo-ethyl]-N-(1,3-benzodioxol-5-yl)thiophene-2-carboxamide CAS Name: N-[2-amino-1-cyclohexyl-1-(3-methoxyphenyl)-2-oxoethyl]-N-(1,3-benzodioxol-5-yl)-2-thiophenecarboxamide IUPAC Name: N-[2-amino-1-cyclohexyl-1-(3-methoxyphenyl)-2-oxoethyl]-N-(1,3-benzodioxol-5-yl)thiophene-2-carboxamide Traditional Name: N-[2-amino-1-cyclohexyl-2-keto-1-(3-methoxyphenyl)ethyl]-N-(1,3-benzodioxol-5-yl)thiophene-2-carboxamide Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2CCCCC2)(C(=O)N)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

Isomeric SMILES

COC1=CC=CC(=C1)C(C2CCCCC2)(C(=O)N)N(C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H28N2O5S/c1-32-21-10-5-9-19(15-21)27(26(28)31,18-7-3-2-4-8-18)29(25(30)24-11-6-14-35-24)20-12-13-22-23(16-20)34-17-33-22/h5-6,9-16,18H,2-4,7-8,17H2,1H3,(H2,28,31)