N-[3-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[(3-nitro-4-pyrrolidin-1-yl-benzoyl)amino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(3-nitro-4-pyrrolidin-1-ylbenzoyl)amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[(3-nitro-4-pyrrolidino-benzoyl)amino]phenyl]thiophene-2-carboxamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)NC(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N4O4S/c27-21(15-8-9-18(19(13-15)26(29)30)25-10-1-2-11-25)23-16-5-3-6-17(14-16)24-22(28)20-7-4-12-31-20/h3-9,12-14H,1-2,10-11H2,(H,23,27)(H,24,28)