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

Systemtic Name: N-[(2S)-1-[ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[(1S)-1-[ethyl-[2-(isopropylamino)-2-oxo-ethyl]carbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[(2S)-1-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[(2S)-1-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: N-[(1S)-1-[ethyl-[2-(isopropylamino)-2-keto-ethyl]carbamoyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C20H31N3O4S MolecularWeight: 409.54284

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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=C1OC

Isomeric SMILES

CCN(CC(=O)NC(C)C)C(=O)[C@H](CCSC)NC(=O)C1=CC=CC=C1OC

InChI

InChI=1S/C20H31N3O4S/c1-6-23(13-18(24)21-14(2)3)20(26)16(11-12-28-5)22-19(25)15-9-7-8-10-17(15)27-4/h7-10,14,16H,6,11-13H2,1-5H3,(H,21,24)(H,22,25)/t16-/m0/s1