5-azanyl-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-[3,5-ditert-butyl-4-[ethoxy(methoxy)methoxy]phenyl]-N-methyl-1,2,4-triazole-1-carbothioamide Formula: C22H35N5O3S MolecularWeight: 449.61

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(OC)OC1=C(C=C(C=C1C(C)(C)C)C2=NN(C(=N2)N)C(=S)NC)C(C)(C)C

Isomeric SMILES

CCOC(OC)OC1=C(C=C(C=C1C(C)(C)C)C2=NN(C(=N2)N)C(=S)NC)C(C)(C)C

InChI

InChI=1S/C22H35N5O3S/c1-10-29-20(28-9)30-16-14(21(2,3)4)11-13(12-15(16)22(5,6)7)17-25-18(23)27(26-17)19(31)24-8/h11-12,20H,10H2,1-9H3,(H,24,31)(H2,23,25,26)