2-azanyl-N-[4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-azanyl-N-[4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-1,3-benzothiazole-6-carboxamide Openeye Name: 2-amino-N-[1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-amino-N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-amino-N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-1,3-benzothiazole-6-carboxamide Traditional Name: 2-amino-N-[1-benzyl-2-hydroxy-3-[isobutyl-(4-methoxyphenyl)sulfonyl-amino]propyl]-1,3-benzothiazole-6-carboxamide Formula: C29H34N4O5S2 MolecularWeight: 582.73406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N)O)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N)O)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H34N4O5S2/c1-19(2)17-33(40(36,37)23-12-10-22(38-3)11-13-23)18-26(34)25(15-20-7-5-4-6-8-20)31-28(35)21-9-14-24-27(16-21)39-29(30)32-24/h4-14,16,19,25-26,34H,15,17-18H2,1-3H3,(H2,30,32)(H,31,35)