(5S)-5-methyl-N'-(3-morpholin-4-ylsulfonylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-5-methyl-N'-(3-morpholin-4-ylsulfonylphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-5-methyl-N'-(3-morpholinosulfonylbenzoyl)-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-5-methyl-N'-[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-5-methyl-N'-(3-morpholin-4-ylsulfonylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-5-methyl-N'-(3-morpholinosulfonylbenzoyl)-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H25N3O5S2/c1-14-5-6-18-16(11-14)13-19(30-18)21(26)23-22-20(25)15-3-2-4-17(12-15)31(27,28)24-7-9-29-10-8-24/h2-4,12-14H,5-11H2,1H3,(H,22,25)(H,23,26)/t14-/m0/s1