2-[[2-azanyl-3-(1,3-thiazol-4-yl)propanoyl]amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate

Systemtic Name: 2-[[2-azanyl-3-(1,3-thiazol-4-yl)propanoyl]amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate Openeye Name: 2-[(2-amino-3-thiazol-4-yl-propanoyl)amino]-3-(4-benzyloxyphenyl)-N-tert-butyl-propanimidate CAS Name: 2-[[2-amino-1-oxo-3-(4-thiazolyl)propyl]amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate IUPAC Name: 2-[[2-amino-3-(1,3-thiazol-4-yl)propanoyl]amino]-N-tert-butyl-3-(4-phenylmethoxyphenyl)propanimidate Traditional Name: 2-[(2-amino-3-thiazol-4-yl-propanoyl)amino]-3-(4-benzoxyphenyl)-N-tert-butyl-propionimidate Formula: C26H31N4O3S- MolecularWeight: 479.61434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CSC=N3)N)[O-]

Isomeric SMILES

CC(C)(C)N=C(C(CC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C(CC3=CSC=N3)N)[O-]

InChI

InChI=1S/C26H32N4O3S/c1-26(2,3)30-25(32)23(29-24(31)22(27)14-20-16-34-17-28-20)13-18-9-11-21(12-10-18)33-15-19-7-5-4-6-8-19/h4-12,16-17,22-23H,13-15,27H2,1-3H3,(H,29,31)(H,30,32)/p-1