tert-butyl N-[[4-(4-butylsulfanylbutanoylamino)phenyl]carbamoylamino]carbamate

Systemtic Name: tert-butyl N-[[4-(4-butylsulfanylbutanoylamino)phenyl]carbamoylamino]carbamate Openeye Name: tert-butyl N-[[4-(4-butylsulfanylbutanoylamino)phenyl]carbamoylamino]carbamate CAS Name: N-[[[4-[[4-(butylthio)-1-oxobutyl]amino]anilino]-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-(4-butylsulfanylbutanoylamino)phenyl]carbamoylamino]carbamate Traditional Name: N-[[4-[4-(butylthio)butanoylamino]phenyl]carbamoylamino]carbamic acid tert-butyl ester Formula: C20H32N4O4S MolecularWeight: 424.55748

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCC(=O)NC1=CC=C(C=C1)NC(=O)NNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCSCCCC(=O)NC1=CC=C(C=C1)NC(=O)NNC(=O)OC(C)(C)C

InChI

InChI=1S/C20H32N4O4S/c1-5-6-13-29-14-7-8-17(25)21-15-9-11-16(12-10-15)22-18(26)23-24-19(27)28-20(2,3)4/h9-12H,5-8,13-14H2,1-4H3,(H,21,25)(H,24,27)(H2,22,23,26)