3-azanyl-N-(4-chloranyl-3-nitro-phenyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(4-chloranyl-3-nitro-phenyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(4-chloro-3-nitro-phenyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(4-chloro-3-nitrophenyl)-7-methyl-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(4-chloro-3-nitrophenyl)-7-methylthieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(4-chloro-3-nitro-phenyl)-7-methyl-thieno[2,3-b]quinoline-2-carboxamide Formula: C19H13ClN4O3S MolecularWeight: 412.84952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC2=NC3=C(C=C2C=C1)C(=C(S3)C(=O)NC4=CC(=C(C=C4)Cl)[N+](=O)[O-])N

InChI

InChI=1S/C19H13ClN4O3S/c1-9-2-3-10-7-12-16(21)17(28-19(12)23-14(10)6-9)18(25)22-11-4-5-13(20)15(8-11)24(26)27/h2-8H,21H2,1H3,(H,22,25)