N2,N5-bis(3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide

Systemtic Name: N2,N5-bis(3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide Openeye Name: N2,N5-bis(3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)pyridine-2,5-dicarboxamide CAS Name: N2,N5-bis(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyridine-2,5-dicarboxamide Traditional Name: N,N'-bis(3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)isocinchomeronamide Formula: C27H29N5O4S2 MolecularWeight: 551.68026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)C)C(=O)N

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CN=C(C=C3)C(=O)NC4=C(C5=C(S4)CC(CC5)C)C(=O)N

InChI

InChI=1S/C27H29N5O4S2/c1-12-3-6-15-18(9-12)37-26(20(15)22(28)33)31-24(35)14-5-8-17(30-11-14)25(36)32-27-21(23(29)34)16-7-4-13(2)10-19(16)38-27/h5,8,11-13H,3-4,6-7,9-10H2,1-2H3,(H2,28,33)(H2,29,34)(H,31,35)(H,32,36)