tert-butyl N-[6-methyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[6-methyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]carbamate Openeye Name: tert-butyl N-[6-methyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]carbamate CAS Name: N-[6-methyl-5-(4-nitrophenyl)-4-thieno[2,3-d]pyrimidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[6-methyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]carbamate Traditional Name: N-[6-methyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-4-yl]carbamic acid tert-butyl ester Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC(=O)OC(C)(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC(=O)OC(C)(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O4S/c1-10-13(11-5-7-12(8-6-11)22(24)25)14-15(19-9-20-16(14)27-10)21-17(23)26-18(2,3)4/h5-9H,1-4H3,(H,19,20,21,23)