propyl N-[3-butylsulfanyl-1-[2-[(4-carbamimidoylcyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: propyl N-[3-butylsulfanyl-1-[2-[(4-carbamimidoylcyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: propyl N-[2-butylsulfanyl-1-[2-[(4-carbamimidoylcyclohexyl)methylcarbamoyl]pyrrolidine-1-carbonyl]-2-methyl-propyl]carbamate CAS Name: N-[3-(butylthio)-1-[2-[[(4-carbamimidoylcyclohexyl)methylamino]-oxomethyl]-1-pyrrolidinyl]-3-methyl-1-oxobutan-2-yl]carbamic acid propyl ester IUPAC Name: propyl N-[3-butylsulfanyl-1-[2-[(4-carbamimidoylcyclohexyl)methylcarbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[1-[2-[(4-amidinocyclohexyl)methylcarbamoyl]pyrrolidine-1-carbonyl]-2-(butylthio)-2-methyl-propyl]carbamic acid propyl ester Formula: C26H47N5O4S MolecularWeight: 525.74748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(C)(C)C(C(=O)N1CCCC1C(=O)NCC2CCC(CC2)C(=N)N)NC(=O)OCCC

Isomeric SMILES

CCCCSC(C)(C)C(C(=O)N1CCCC1C(=O)NCC2CCC(CC2)C(=N)N)NC(=O)OCCC

InChI

InChI=1S/C26H47N5O4S/c1-5-7-16-36-26(3,4)21(30-25(34)35-15-6-2)24(33)31-14-8-9-20(31)23(32)29-17-18-10-12-19(13-11-18)22(27)28/h18-21H,5-17H2,1-4H3,(H3,27,28)(H,29,32)(H,30,34)