4-propyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-propyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-propyl-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)thiadiazole-5-carboxamide CAS Name: 4-propyl-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)-5-thiadiazolecarboxamide IUPAC Name: 4-propyl-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)thiadiazole-5-carboxamide Traditional Name: N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)-4-propyl-thiadiazole-5-carboxamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(SN=N1)C(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C

Isomeric SMILES

CCCC1=C(SN=N1)C(=O)NC2=CC3=C(C=C2)N(C(=O)C(CO3)(C)C)C

InChI

InChI=1S/C18H22N4O3S/c1-5-6-12-15(26-21-20-12)16(23)19-11-7-8-13-14(9-11)25-10-18(2,3)17(24)22(13)4/h7-9H,5-6,10H2,1-4H3,(H,19,23)