propan-2-yl N-[1-[2-[(4-azanylcyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-cyclopentylsulfanyl-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: propan-2-yl N-[1-[2-[(4-azanylcyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-cyclopentylsulfanyl-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: isopropyl N-[1-[2-[(4-aminocyclohexyl)methylcarbamoyl]pyrrolidine-1-carbonyl]-2-cyclopentylsulfanyl-2-methyl-propyl]carbamate CAS Name: N-[1-[2-[[(4-aminocyclohexyl)methylamino]-oxomethyl]-1-pyrrolidinyl]-3-(cyclopentylthio)-3-methyl-1-oxobutan-2-yl]carbamic acid propan-2-yl ester IUPAC Name: propan-2-yl N-[1-[2-[(4-aminocyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-cyclopentylsulfanyl-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[2-[(4-aminocyclohexyl)methylcarbamoyl]pyrrolidine-1-carbonyl]-2-(cyclopentylthio)-2-methyl-propyl]carbamic acid isopropyl ester Formula: C26H46N4O4S MolecularWeight: 510.73284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)NC(C(=O)N1CCCC1C(=O)NCC2CCC(CC2)N)C(C)(C)SC3CCCC3

Isomeric SMILES

CC(C)OC(=O)NC(C(=O)N1CCCC1C(=O)NCC2CCC(CC2)N)C(C)(C)SC3CCCC3

InChI

InChI=1S/C26H46N4O4S/c1-17(2)34-25(33)29-22(26(3,4)35-20-8-5-6-9-20)24(32)30-15-7-10-21(30)23(31)28-16-18-11-13-19(27)14-12-18/h17-22H,5-16,27H2,1-4H3,(H,28,31)(H,29,33)