4-(2-methoxyethylamino)-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-(2-methoxyethylamino)-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: 4-(2-methoxyethylamino)-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 4-(2-methoxyethylamino)-3-nitro-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C17H23N5O4S/c1-4-11(5-2)16-20-21-17(27-16)19-15(23)12-6-7-13(18-8-9-26-3)14(10-12)22(24)25/h6-7,10-11,18H,4-5,8-9H2,1-3H3,(H,19,21,23)