2-[2-(3-methylbutylamino)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(3-methylbutylamino)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(isopentylamino)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-(3-methylbutylamino)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(3-methylbutylamino)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(isoamylamino)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N

Isomeric SMILES

CC(C)CCNCC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)N

InChI

InChI=1S/C16H25N3O2S/c1-10(2)7-8-18-9-13(20)19-16-14(15(17)21)11-5-3-4-6-12(11)22-16/h10,18H,3-9H2,1-2H3,(H2,17,21)(H,19,20)