N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)nicotinamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)NC(=O)C2=C(N=CC=C2)SC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)NC(=O)C2=C(N=CC=C2)SC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N3O3S2/c1-21(2,3)17-12-28-20(23-17)24-18(25)14-5-4-8-22-19(14)29-13-6-7-15-16(11-13)27-10-9-26-15/h4-8,11-12H,9-10H2,1-3H3,(H,23,24,25)