methyl 2-[[(2R)-4-methylsulfanyl-2-[[(2S)-2-naphthalen-1-ylpropanoyl]amino]butanoyl]amino]ethanoate

Systemtic Name: methyl 2-[[(2R)-4-methylsulfanyl-2-[[(2S)-2-naphthalen-1-ylpropanoyl]amino]butanoyl]amino]ethanoate Openeye Name: methyl 2-[[(2R)-4-methylsulfanyl-2-[[(2S)-2-(1-naphthyl)propanoyl]amino]butanoyl]amino]acetate CAS Name: 2-[[(2R)-4-(methylthio)-2-[[(2S)-2-(1-naphthalenyl)-1-oxopropyl]amino]-1-oxobutyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[(2R)-4-methylsulfanyl-2-[[(2S)-2-naphthalen-1-ylpropanoyl]amino]butanoyl]amino]acetate Traditional Name: 2-[[(2R)-4-(methylthio)-2-[[(2S)-2-(1-naphthyl)propanoyl]amino]butanoyl]amino]acetic acid methyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC(CCSC)C(=O)NCC(=O)OC

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)C(=O)N[C@H](CCSC)C(=O)NCC(=O)OC

InChI

InChI=1S/C21H26N2O4S/c1-14(16-10-6-8-15-7-4-5-9-17(15)16)20(25)23-18(11-12-28-3)21(26)22-13-19(24)27-2/h4-10,14,18H,11-13H2,1-3H3,(H,22,26)(H,23,25)/t14-,18+/m0/s1