N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanamide Openeye Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenyl-3-(p-tolylsulfonylamino)propanamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-phenyl-3-(tosylamino)propionamide Formula: C30H27N3O3S2 MolecularWeight: 541.68368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C30H27N3O3S2/c1-20-8-15-25(16-9-20)38(35,36)33-27(22-6-4-3-5-7-22)19-29(34)31-24-13-11-23(12-14-24)30-32-26-17-10-21(2)18-28(26)37-30/h3-18,27,33H,19H2,1-2H3,(H,31,34)