2-[3-[(4-isocyanophenyl)methyl]-6-nitro-indolizin-1-yl]-N-(3-methyl-1,2-thiazol-5-yl)-2-oxidanylidene-ethanamide

Systemtic Name: 2-[3-[(4-isocyanophenyl)methyl]-6-nitro-indolizin-1-yl]-N-(3-methyl-1,2-thiazol-5-yl)-2-oxidanylidene-ethanamide Openeye Name: 2-[3-[(4-isocyanophenyl)methyl]-6-nitro-indolizin-1-yl]-N-(3-methylisothiazol-5-yl)-2-oxo-acetamide CAS Name: 2-[3-[(4-isocyanophenyl)methyl]-6-nitro-1-indolizinyl]-N-(3-methyl-5-isothiazolyl)-2-oxoacetamide IUPAC Name: 2-[3-[(4-isocyanophenyl)methyl]-6-nitroindolizin-1-yl]-N-(3-methyl-1,2-thiazol-5-yl)-2-oxoacetamide Traditional Name: 2-[3-(4-isocyanobenzyl)-6-nitro-indolizin-1-yl]-2-keto-N-(3-methylisothiazol-5-yl)acetamide Formula: C22H15N5O4S MolecularWeight: 445.4506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1)NC(=O)C(=O)C2=C3C=CC(=CN3C(=C2)CC4=CC=C(C=C4)[N+]#[C-])[N+](=O)[O-]

Isomeric SMILES

CC1=NSC(=C1)NC(=O)C(=O)C2=C3C=CC(=CN3C(=C2)CC4=CC=C(C=C4)[N+]#[C-])[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O4S/c1-13-9-20(32-25-13)24-22(29)21(28)18-11-17(10-14-3-5-15(23-2)6-4-14)26-12-16(27(30)31)7-8-19(18)26/h3-9,11-12H,10H2,1H3,(H,24,29)