N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)-3-nitro-4-piperidino-benzamide Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4S/c1-2-14-11-15-19(30-14)21-12-24(20(15)27)22-18(26)13-6-7-16(17(10-13)25(28)29)23-8-4-3-5-9-23/h6-7,10-12H,2-5,8-9H2,1H3,(H,22,26)