N-[(2S)-2-[[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]carbamoyl]-3-methyl-butyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2S)-2-[[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]carbamoyl]-3-methyl-butyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(2S)-2-[[2-(4-methoxyphenyl)-2-oxo-ethyl]carbamoyl]-3-methyl-butyl]benzothiophene-2-carboxamide CAS Name: N-[(2S)-2-[[[2-(4-methoxyphenyl)-2-oxoethyl]amino]-oxomethyl]-3-methylbutyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2S)-2-[[2-(4-methoxyphenyl)-2-oxoethyl]carbamoyl]-3-methylbutyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[(2S)-2-[[2-keto-2-(4-methoxyphenyl)ethyl]carbamoyl]-3-methyl-butyl]benzothiophene-2-carboxamide Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC2=CC=CC=C2S1)C(=O)NCC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[C@@H](CNC(=O)C1=CC2=CC=CC=C2S1)C(=O)NCC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H26N2O4S/c1-15(2)19(13-25-24(29)22-12-17-6-4-5-7-21(17)31-22)23(28)26-14-20(27)16-8-10-18(30-3)11-9-16/h4-12,15,19H,13-14H2,1-3H3,(H,25,29)(H,26,28)/t19-/m1/s1