5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-3-tert-butyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide

Systemtic Name: 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methylsulfanyl]-3-tert-butyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Openeye Name: 3-tert-butyl-5-[(1,3-dioxoisoindolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,2,4-triazole-1-carboxamide CAS Name: 3-tert-butyl-5-[(1,3-dioxo-2-isoindolyl)methylthio]-N,N-dimethyl-1,2,4-triazole-1-carboxamide IUPAC Name: 3-tert-butyl-5-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]-N,N-dimethyl-1,2,4-triazole-1-carboxamide Traditional Name: 3-tert-butyl-N,N-dimethyl-5-(phthalimidomethylthio)-1,2,4-triazole-1-carboxamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=N1)SCN2C(=O)C3=CC=CC=C3C2=O)C(=O)N(C)C

Isomeric SMILES

CC(C)(C)C1=NN(C(=N1)SCN2C(=O)C3=CC=CC=C3C2=O)C(=O)N(C)C

InChI

InChI=1S/C18H21N5O3S/c1-18(2,3)15-19-16(23(20-15)17(26)21(4)5)27-10-22-13(24)11-8-6-7-9-12(11)14(22)25/h6-9H,10H2,1-5H3