N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(tetrahydrofuran-2-ylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(2-oxolanylmethyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(oxolan-2-ylmethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-methyl-3-nitro-N-(tetrahydrofurfuryl)benzamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC2CCCO2)C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4S/c1-13-8-9-14(11-17(13)23(25)26)19(24)22(12-15-5-4-10-27-15)20-21-16-6-2-3-7-18(16)28-20/h2-3,6-9,11,15H,4-5,10,12H2,1H3