2-[2-[[(1S)-1-(4-butylphenyl)-2-methyl-propyl]amino]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[[(1S)-1-(4-butylphenyl)-2-methyl-propyl]amino]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[[(1S)-1-(4-butylphenyl)-2-methyl-propyl]amino]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[(1S)-1-(4-butylphenyl)-2-methylpropyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[[(1S)-1-(4-butylphenyl)-2-methylpropyl]amino]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[[(1S)-1-(4-butylphenyl)-2-methyl-propyl]amino]acetyl]amino]thiophene-3-carboxamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C(C)C)NCC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)[C@H](C(C)C)NCC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C21H29N3O2S/c1-4-5-6-15-7-9-16(10-8-15)19(14(2)3)23-13-18(25)24-21-17(20(22)26)11-12-27-21/h7-12,14,19,23H,4-6,13H2,1-3H3,(H2,22,26)(H,24,25)/t19-/m0/s1