2-[2-[[(1R)-2-methyl-1-phenyl-propyl]amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[[(1R)-2-methyl-1-phenyl-propyl]amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[[(1R)-2-methyl-1-phenyl-propyl]amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[[(1R)-2-methyl-1-phenylpropyl]amino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[[(1R)-2-methyl-1-phenylpropyl]amino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[[(1R)-2-methyl-1-phenyl-propyl]amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)NCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

Isomeric SMILES

CC(C)[C@H](C1=CC=CC=C1)NCC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N

InChI

InChI=1S/C21H27N3O2S/c1-13(2)19(14-8-4-3-5-9-14)23-12-17(25)24-21-18(20(22)26)15-10-6-7-11-16(15)27-21/h3-5,8-9,13,19,23H,6-7,10-12H2,1-2H3,(H2,22,26)(H,24,25)/t19-/m1/s1