(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate

Systemtic Name: (2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate Openeye Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate CAS Name: (2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate IUPAC Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butanimidate Traditional Name: (2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-N-(1H-1,2,4-triazol-5-yl)butyrimidate Formula: C18H24N5O2- MolecularWeight: 342.41546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=NC1=NC=NN1)[O-])NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=NC1=NC=NN1)[O-])NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H25N5O2/c1-11(2)14(16(25)22-17-19-10-20-23-17)21-15(24)12-6-8-13(9-7-12)18(3,4)5/h6-11,14H,1-5H3,(H,21,24)(H2,19,20,22,23,25)/p-1/t14-/m0/s1