N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[4-[2-oxo-2-(2-thienylmethylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[4-[2-keto-2-(2-thenylamino)ethyl]phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=C(C=C3)CC(=O)NCC4=CC=CS4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=C(C=C3)CC(=O)NCC4=CC=CS4

InChI

InChI=1S/C22H20N2O4S/c25-21(23-13-17-4-3-11-29-17)12-15-7-9-16(10-8-15)24-22(26)20-14-27-18-5-1-2-6-19(18)28-20/h1-11,20H,12-14H2,(H,23,25)(H,24,26)