N-(1,3-benzothiazol-2-yl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-oxidanylidene-N-(oxolan-2-ylmethyl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-oxo-N-(tetrahydrofuran-2-ylmethyl)isochromane-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-oxo-N-(2-oxolanylmethyl)-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-oxo-N-(oxolan-2-ylmethyl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-keto-N-(tetrahydrofurfuryl)isochroman-3-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CC(OC1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4CC5=CC=CC=C5C(=O)O4

InChI

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