N-[3-[(2-chloranyl-5-nitro-phenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-[(2-chloranyl-5-nitro-phenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-[(2-chloro-5-nitro-phenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-[(2-chloro-5-nitroanilino)-oxomethyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-[(2-chloro-5-nitrophenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-[(2-chloro-5-nitro-phenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-nitro-2-furamide Formula: C21H17ClN4O7S MolecularWeight: 504.90028

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H17ClN4O7S/c1-10-2-4-12-16(8-10)34-21(24-19(27)15-6-7-17(33-15)26(31)32)18(12)20(28)23-14-9-11(25(29)30)3-5-13(14)22/h3,5-7,9-10H,2,4,8H2,1H3,(H,23,28)(H,24,27)