(4-nitrophenyl)methyl N-[2-(4-pyrrolidin-2-yl-1,3-thiazol-2-yl)ethyl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[2-(4-pyrrolidin-2-yl-1,3-thiazol-2-yl)ethyl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[2-(4-pyrrolidin-2-ylthiazol-2-yl)ethyl]carbamate CAS Name: N-[2-[4-(2-pyrrolidinyl)-2-thiazolyl]ethyl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[2-(4-pyrrolidin-2-yl-1,3-thiazol-2-yl)ethyl]carbamate Traditional Name: N-[2-(4-pyrrolidin-2-ylthiazol-2-yl)ethyl]carbamic acid (4-nitrobenzyl) ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C2=CSC(=N2)CCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(NC1)C2=CSC(=N2)CCNC(=O)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c22-17(25-10-12-3-5-13(6-4-12)21(23)24)19-9-7-16-20-15(11-26-16)14-2-1-8-18-14/h3-6,11,14,18H,1-2,7-10H2,(H,19,22)