propan-2-yl 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[4-[3-oxidanylidene-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]phenyl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[4-[3-oxidanylidene-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]phenyl]carbonylamino]propanoate Openeye Name: isopropyl 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[4-[3-oxo-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]benzoyl]amino]propanoate CAS Name: 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[oxo-[4-[3-oxo-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]phenyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[4-[3-oxo-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]benzoyl]amino]propanoate Traditional Name: 2-[(4-tert-butylphenyl)sulfonylamino]-3-[[4-[3-keto-3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)propyl]benzoyl]amino]propionic acid isopropyl ester Formula: C30H41N5O6S MolecularWeight: 599.74144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CNC(=O)C1=CC=C(C=C1)CCC(=O)NC2=NCCCN2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)OC(=O)C(CNC(=O)C1=CC=C(C=C1)CCC(=O)NC2=NCCCN2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C30H41N5O6S/c1-20(2)41-28(38)25(35-42(39,40)24-14-12-23(13-15-24)30(3,4)5)19-33-27(37)22-10-7-21(8-11-22)9-16-26(36)34-29-31-17-6-18-32-29/h7-8,10-15,20,25,35H,6,9,16-19H2,1-5H3,(H,33,37)(H2,31,32,34,36)