5-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-N-(3-pyridylmethyl)benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-N-(3-pyridylmethyl)benzothiophene-2-carboxamide Formula: C25H20N4O3S2 MolecularWeight: 488.5813

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H20N4O3S2/c1-15(2)19-6-3-7-21-23(19)27-25(34-21)28(14-16-5-4-10-26-13-16)24(30)22-12-17-11-18(29(31)32)8-9-20(17)33-22/h3-13,15H,14H2,1-2H3