N-[2-(cyclopentylamino)-2-oxidanylidene-1-thiophen-2-yl-ethyl]-N-(2-hydroxyethyl)benzo[b][1]benzoxepine-5-carboxamide

Systemtic Name: N-[2-(cyclopentylamino)-2-oxidanylidene-1-thiophen-2-yl-ethyl]-N-(2-hydroxyethyl)benzo[b][1]benzoxepine-5-carboxamide Openeye Name: N-[2-(cyclopentylamino)-2-oxo-1-(2-thienyl)ethyl]-N-(2-hydroxyethyl)benzo[b][1]benzoxepine-5-carboxamide CAS Name: N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-N-(2-hydroxyethyl)-5-benzo[b][1]benzoxepincarboxamide IUPAC Name: N-[2-(cyclopentylamino)-2-oxo-1-thiophen-2-ylethyl]-N-(2-hydroxyethyl)benzo[b][1]benzoxepine-5-carboxamide Traditional Name: N-[2-(cyclopentylamino)-2-keto-1-(2-thienyl)ethyl]-N-(2-hydroxyethyl)benzo[b][1]benzoxepin-5-carboxamide Formula: C28H28N2O4S MolecularWeight: 488.59792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=CS2)N(CCO)C(=O)C3=CC4=CC=CC=C4OC5=CC=CC=C53

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=CS2)N(CCO)C(=O)C3=CC4=CC=CC=C4OC5=CC=CC=C53

InChI

InChI=1S/C28H28N2O4S/c31-16-15-30(26(25-14-7-17-35-25)27(32)29-20-9-2-3-10-20)28(33)22-18-19-8-1-5-12-23(19)34-24-13-6-4-11-21(22)24/h1,4-8,11-14,17-18,20,26,31H,2-3,9-10,15-16H2,(H,29,32)