2-(aminocarbonylamino)-3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pentanamide

Systemtic Name: 2-(aminocarbonylamino)-3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pentanamide Openeye Name: 3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-2-ureido-pentanamide CAS Name: 2-(carbamoylamino)-3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pentanamide IUPAC Name: 2-(carbamoylamino)-3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]pentanamide Traditional Name: 3-methyl-N-[3-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]-2-ureido-valeramide Formula: C19H29N5O4S MolecularWeight: 423.52966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)NC(=O)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NCCCCC2)NC(=O)N

InChI

InChI=1S/C19H29N5O4S/c1-3-13(2)17(23-19(20)26)18(25)22-14-8-7-9-15(12-14)29(27,28)24-16-10-5-4-6-11-21-16/h7-9,12-13,17H,3-6,10-11H2,1-2H3,(H,21,24)(H,22,25)(H3,20,23,26)