3-[(5-chloranylthiophen-2-yl)carbonylamino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]oxolane-3-carboxamide

Systemtic Name: 3-[(5-chloranylthiophen-2-yl)carbonylamino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]oxolane-3-carboxamide Openeye Name: 3-[(5-chlorothiophene-2-carbonyl)amino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]tetrahydrofuran-3-carboxamide CAS Name: 3-[[(5-chloro-2-thiophenyl)-oxomethyl]amino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]-3-oxolanecarboxamide IUPAC Name: 3-[(5-chlorothiophene-2-carbonyl)amino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]oxolane-3-carboxamide Traditional Name: 3-[(5-chlorothiophene-2-carbonyl)amino]-N-[4-(5-cyanoimino-1,4-oxazepan-4-yl)phenyl]tetrahydrofuran-3-carboxamide Formula: C22H22ClN5O4S MolecularWeight: 487.95918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN(C1=NC#N)C2=CC=C(C=C2)NC(=O)C3(CCOC3)NC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1COCCN(C1=NC#N)C2=CC=C(C=C2)NC(=O)C3(CCOC3)NC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H22ClN5O4S/c23-18-6-5-17(33-18)20(29)27-22(8-11-32-13-22)21(30)26-15-1-3-16(4-2-15)28-9-12-31-10-7-19(28)25-14-24/h1-6H,7-13H2,(H,26,30)(H,27,29)