propan-2-yl 3-[(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[4-methyl-2-(3-thienyl)thiazole-5-carbonyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[[4-methyl-2-(3-thiophenyl)-5-thiazolyl]-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carbonyl)amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[4-methyl-2-(3-thienyl)thiazole-5-carbonyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CSC=C2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CSC=C2)C(=O)NC(CC(=O)OC(C)C)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S2/c1-12(2)29-18(25)10-16(15-6-4-5-7-17(15)24(27)28)23-20(26)19-13(3)22-21(31-19)14-8-9-30-11-14/h4-9,11-12,16H,10H2,1-3H3,(H,23,26)