[4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid

Systemtic Name: [4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-3-oxidanyl-1-phenyl-butan-2-yl]carbamic acid Openeye Name: [1-benzyl-2-hydroxy-3-[isobutyl-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfonyl]amino]propyl]carbamic acid CAS Name: [3-hydroxy-4-[2-methylpropyl-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfonyl]amino]-1-phenylbutan-2-yl]carbamic acid IUPAC Name: [3-hydroxy-4-[2-methylpropyl-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-1-phenylbutan-2-yl]carbamic acid Traditional Name: [1-benzyl-2-hydroxy-3-[isobutyl-[[2-(methylthio)-1,3-benzothiazol-6-yl]sulfonyl]amino]propyl]carbamic acid Formula: C23H29N3O5S3 MolecularWeight: 523.68846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)O)O)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C23H29N3O5S3/c1-15(2)13-26(14-20(27)19(24-22(28)29)11-16-7-5-4-6-8-16)34(30,31)17-9-10-18-21(12-17)33-23(25-18)32-3/h4-10,12,15,19-20,24,27H,11,13-14H2,1-3H3,(H,28,29)