3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(2-methyl-4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(2-methyl-4-oxidanylidene-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: 3-(3-methyl-4-nitro-pyrazol-1-yl)-N-(2-methyl-4-oxo-6-propyl-thieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: 3-(3-methyl-4-nitro-1-pyrazolyl)-N-(2-methyl-4-oxo-6-propyl-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: 3-(3-methyl-4-nitropyrazol-1-yl)-N-(2-methyl-4-oxo-6-propylthieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(4-keto-2-methyl-6-propyl-thieno[2,3-d]pyrimidin-3-yl)-3-(3-methyl-4-nitro-pyrazol-1-yl)propionamide Formula: C17H20N6O4S MolecularWeight: 404.4435

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(S1)N=C(N(C2=O)NC(=O)CCN3C=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CCCC1=CC2=C(S1)N=C(N(C2=O)NC(=O)CCN3C=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N6O4S/c1-4-5-12-8-13-16(28-12)18-11(3)22(17(13)25)20-15(24)6-7-21-9-14(23(26)27)10(2)19-21/h8-9H,4-7H2,1-3H3,(H,20,24)