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

Systemtic Name: N-[2-methoxy-4-[(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[2-methoxy-4-[(3-nitro-4-pyrrolidin-1-yl-benzoyl)amino]phenyl]thiophene-2-carboxamide CAS Name: N-[2-methoxy-4-[[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-methoxy-4-[(3-nitro-4-pyrrolidin-1-ylbenzoyl)amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-methoxy-4-[(3-nitro-4-pyrrolidino-benzoyl)amino]phenyl]thiophene-2-carboxamide Formula: C23H22N4O5S MolecularWeight: 466.50958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])NC(=O)C4=CC=CS4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-])NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H22N4O5S/c1-32-20-14-16(7-8-17(20)25-23(29)21-5-4-12-33-21)24-22(28)15-6-9-18(19(13-15)27(30)31)26-10-2-3-11-26/h4-9,12-14H,2-3,10-11H2,1H3,(H,24,28)(H,25,29)