N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-5-nitro-thiophene-3-carboxamide

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-5-nitro-thiophene-3-carboxamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-5-nitro-thiophene-3-carboxamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-5-nitro-3-thiophenecarboxamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-5-nitrothiophene-3-carboxamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-5-nitro-thiophene-3-carboxamide Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O4S/c20-15(12-7-14(19(22)23)24-9-12)17-8-10-2-1-3-13(6-10)18-16(21)11-4-5-11/h1-3,6-7,9,11H,4-5,8H2,(H,17,20)(H,18,21)