N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[5-[[cyclopropyl(oxo)methyl]amino]-2-methylphenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C20H17N3O4S MolecularWeight: 395.43168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O4S/c1-11-2-5-14(21-19(24)12-3-4-12)10-16(11)22-20(25)18-9-13-8-15(23(26)27)6-7-17(13)28-18/h2,5-10,12H,3-4H2,1H3,(H,21,24)(H,22,25)