N-[3-aminocarbonyl-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophen-2-yl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-aminocarbonyl-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophen-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methyl-2-thienyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methyl-2-thiophenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-carbamoyl-4-methylthiophen-2-yl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-carbamoyl-4-methyl-5-piperonyl-2-thienyl)-5-nitro-benzothiophene-2-carboxamide Formula: C23H17N3O6S2 MolecularWeight: 495.52758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H17N3O6S2/c1-11-18(7-12-2-4-15-16(6-12)32-10-31-15)34-23(20(11)21(24)27)25-22(28)19-9-13-8-14(26(29)30)3-5-17(13)33-19/h2-6,8-9H,7,10H2,1H3,(H2,24,27)(H,25,28)