5-azanyl-1-ethyl-2-methylsulfanyl-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-azanyl-1-ethyl-2-methylsulfanyl-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 5-amino-1-ethyl-2-methylsulfanyl-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 5-amino-1-ethyl-2-(methylthio)-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide IUPAC Name: 5-amino-1-ethyl-2-methylsulfanyl-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 5-amino-1-ethyl-2-(methylthio)-4-(3-nitrophenyl)-7aH-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C16H17N5O3S2 MolecularWeight: 391.46788

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C(=C(N=C1SC)C3=CC(=CC=C3)[N+](=O)[O-])C(=C(S2)C(=O)N)N

Isomeric SMILES

CCN1C2C(=C(N=C1SC)C3=CC(=CC=C3)[N+](=O)[O-])C(=C(S2)C(=O)N)N

InChI

InChI=1S/C16H17N5O3S2/c1-3-20-15-10(11(17)13(26-15)14(18)22)12(19-16(20)25-2)8-5-4-6-9(7-8)21(23)24/h4-7,15H,3,17H2,1-2H3,(H2,18,22)