2-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-2-nitro-N-(3-pyridylmethyl)benzamide CAS Name: 2-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: N-(4-isopropyl-1,3-benzothiazol-2-yl)-2-nitro-N-(3-pyridylmethyl)benzamide Formula: C23H20N4O3S MolecularWeight: 432.4949

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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=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O3S/c1-15(2)17-9-5-11-20-21(17)25-23(31-20)26(14-16-7-6-12-24-13-16)22(28)18-8-3-4-10-19(18)27(29)30/h3-13,15H,14H2,1-2H3