tert-butyl N-[1-[4-[bis(azanyl)methylidenecarbamoyl]-2-sulfamoyl-phenyl]piperidin-4-yl]carbamate

Systemtic Name: tert-butyl N-[1-[4-[bis(azanyl)methylidenecarbamoyl]-2-sulfamoyl-phenyl]piperidin-4-yl]carbamate Openeye Name: tert-butyl N-[1-[4-(diaminomethylenecarbamoyl)-2-sulfamoyl-phenyl]-4-piperidyl]carbamate CAS Name: N-[1-[4-[(diaminomethylideneamino)-oxomethyl]-2-sulfamoylphenyl]-4-piperidinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[4-(diaminomethylidenecarbamoyl)-2-sulfamoylphenyl]piperidin-4-yl]carbamate Traditional Name: N-[1-[4-(diaminomethylenecarbamoyl)-2-sulfamoyl-phenyl]-4-piperidyl]carbamic acid tert-butyl ester Formula: C18H28N6O5S MolecularWeight: 440.51712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N=C(N)N)S(=O)(=O)N

InChI

InChI=1S/C18H28N6O5S/c1-18(2,3)29-17(26)22-12-6-8-24(9-7-12)13-5-4-11(15(25)23-16(19)20)10-14(13)30(21,27)28/h4-5,10,12H,6-9H2,1-3H3,(H,22,26)(H2,21,27,28)(H4,19,20,23,25)