tert-butyl N-(2-azanyl-4-methyl-pentanoyl)-N-[4-methylsulfanyl-1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-(2-azanyl-4-methyl-pentanoyl)-N-[4-methylsulfanyl-1-(naphthalen-2-ylamino)-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: tert-butyl N-(2-amino-4-methyl-pentanoyl)-N-[3-methylsulfanyl-1-(2-naphthylcarbamoyl)propyl]carbamate CAS Name: N-(2-amino-4-methyl-1-oxopentyl)-N-[4-(methylthio)-1-(2-naphthalenylamino)-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(2-amino-4-methylpentanoyl)-N-[4-methylsulfanyl-1-(naphthalen-2-ylamino)-1-oxobutan-2-yl]carbamate Traditional Name: N-(2-amino-4-methyl-pentanoyl)-N-[3-(methylthio)-1-(2-naphthylcarbamoyl)propyl]carbamic acid tert-butyl ester Formula: C26H37N3O4S MolecularWeight: 487.65468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C(CCSC)C(=O)NC1=CC2=CC=CC=C2C=C1)C(=O)OC(C)(C)C)N

Isomeric SMILES

CC(C)CC(C(=O)N(C(CCSC)C(=O)NC1=CC2=CC=CC=C2C=C1)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C26H37N3O4S/c1-17(2)15-21(27)24(31)29(25(32)33-26(3,4)5)22(13-14-34-6)23(30)28-20-12-11-18-9-7-8-10-19(18)16-20/h7-12,16-17,21-22H,13-15,27H2,1-6H3,(H,28,30)