5-nitro-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)furan-2-carboxamide

Systemtic Name: 5-nitro-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)furan-2-carboxamide Openeye Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-furan-2-carboxamide CAS Name: 5-nitro-N-(phenylmethyl)-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-2-furancarboxamide IUPAC Name: N-benzyl-5-nitro-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)furan-2-carboxamide Traditional Name: N-benzyl-N-(4-isopropyl-1,3-benzothiazol-2-yl)-5-nitro-2-furamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-14(2)16-9-6-10-18-20(16)23-22(30-18)24(13-15-7-4-3-5-8-15)21(26)17-11-12-19(29-17)25(27)28/h3-12,14H,13H2,1-2H3