N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-morpholinosulfonyl-benzamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-4-ethyl-N-methyl-3-morpholinosulfonyl-benzamide Formula: C23H27N3O4S2 MolecularWeight: 473.60818

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)N(C)[C@H](C)C2=NC3=CC=CC=C3S2)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H27N3O4S2/c1-4-17-9-10-18(15-21(17)32(28,29)26-11-13-30-14-12-26)23(27)25(3)16(2)22-24-19-7-5-6-8-20(19)31-22/h5-10,15-16H,4,11-14H2,1-3H3/t16-/m1/s1