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

Systemtic Name: 5-nitro-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-N-(tetrahydrofuran-2-ylmethyl)thiophene-2-carboxamide CAS Name: 5-nitro-N-(2-oxolanylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 5-nitro-N-(oxolan-2-ylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-N-(tetrahydrofurfuryl)thiophene-2-carboxamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3CCCO3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3CCCO3)C(=O)C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O4S2/c1-12(2)14-6-3-7-15-18(14)21-20(29-15)22(11-13-5-4-10-27-13)19(24)16-8-9-17(28-16)23(25)26/h3,6-9,12-13H,4-5,10-11H2,1-2H3