2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiophene-3-carboxamide Formula: C17H15N5O4S MolecularWeight: 385.3971

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(S2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C17H15N5O4S/c18-16(24)14-7-13(6-11-4-2-1-3-5-11)27-17(14)20-15(23)10-21-9-12(8-19-21)22(25)26/h1-5,7-9H,6,10H2,(H2,18,24)(H,20,23)