3-[4-azanyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-6-yl]-N,N-dimethyl-propanamide

Systemtic Name: 3-[4-azanyl-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-6-yl]-N,N-dimethyl-propanamide Openeye Name: 3-[4-amino-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-6-yl]-N,N-dimethyl-propanamide CAS Name: 3-[4-amino-5-(4-nitrophenyl)-6-thieno[2,3-d]pyrimidinyl]-N,N-dimethylpropanamide IUPAC Name: 3-[4-amino-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-6-yl]-N,N-dimethylpropanamide Traditional Name: 3-[4-amino-5-(4-nitrophenyl)thieno[2,3-d]pyrimidin-6-yl]-N,N-dimethyl-propionamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=C(C2=C(N=CN=C2S1)N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CCC1=C(C2=C(N=CN=C2S1)N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3S/c1-21(2)13(23)8-7-12-14(10-3-5-11(6-4-10)22(24)25)15-16(18)19-9-20-17(15)26-12/h3-6,9H,7-8H2,1-2H3,(H2,18,19,20)