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

Systemtic Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]propanamide Openeye Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(2-morpholinosulfonylphenyl)methyl]propanamide CAS Name: 2-(1,3-benzothiazol-2-ylamino)-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]propanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylamino)-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]propanamide Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-N-(2-morpholinosulfonylbenzyl)propionamide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCOCC2)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1S(=O)(=O)N2CCOCC2)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H24N4O4S2/c1-15(23-21-24-17-7-3-4-8-18(17)30-21)20(26)22-14-16-6-2-5-9-19(16)31(27,28)25-10-12-29-13-11-25/h2-9,15H,10-14H2,1H3,(H,22,26)(H,23,24)