N-(1,3-benzodioxol-5-ylmethyl)-2-(cyclobutylcarbonylamino)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(cyclobutylcarbonylamino)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(cyclobutanecarbonylamino)-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[cyclobutyl(oxo)methyl]amino]-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(cyclobutanecarbonylamino)-7-oxo-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Traditional Name: 2-(cyclobutanecarbonylamino)-7-keto-N-piperonyl-5,6-dihydro-4H-1,3-benzothiazole-5-carboxamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N3O5S/c25-15-8-13(19(26)22-9-11-4-5-16-17(6-11)29-10-28-16)7-14-18(15)30-21(23-14)24-20(27)12-2-1-3-12/h4-6,12-13H,1-3,7-10H2,(H,22,26)(H,23,24,27)