2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-morpholinosulfonylphenyl)propanamide CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[3-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-morpholinosulfonylphenyl)propionamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)N(C)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)N(C)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H26N4O4S2/c1-16(25(2)15-21-24-19-8-3-4-9-20(19)31-21)22(27)23-17-6-5-7-18(14-17)32(28,29)26-10-12-30-13-11-26/h3-9,14,16H,10-13,15H2,1-2H3,(H,23,27)