N-[(2S)-1-[ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[(2S)-1-[ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-1-[ethyl-[2-(isopropylamino)-2-oxo-ethyl]carbamoyl]-3-methylsulfanyl-propyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-4-(methylthio)-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[(1S)-1-[ethyl-[2-(isopropylamino)-2-keto-ethyl]carbamoyl]-3-(methylthio)propyl]-3-methyl-benzamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)C)C(=O)C(CCSC)NC(=O)C1=CC(=CC=C1)C

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)[C@H](CCSC)NC(=O)C1=CC(=CC=C1)C

InChI

InChI=1S/C20H31N3O3S/c1-6-23(13-18(24)21-14(2)3)20(26)17(10-11-27-5)22-19(25)16-9-7-8-15(4)12-16/h7-9,12,14,17H,6,10-11,13H2,1-5H3,(H,21,24)(H,22,25)/t17-/m0/s1