2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]butanediamide

Systemtic Name: 2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]butanediamide Openeye Name: 2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]butanediamide CAS Name: 2-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]butanediamide IUPAC Name: 2-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]butanediamide Traditional Name: 2-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]succinamide Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC(CC(=O)N)C(=O)N

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC(CC(=O)N)C(=O)N

InChI

InChI=1S/C14H19N3O3S/c1-7-2-3-10-8(4-7)5-11(21-10)14(20)17-9(13(16)19)6-12(15)18/h5,7,9H,2-4,6H2,1H3,(H2,15,18)(H2,16,19)(H,17,20)