N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-N-(phenylmethyl)benzamide

Systemtic Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide CAS Name: N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-(4-morpholinylsulfonyl)-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-benzyl-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide Formula: C27H27N3O4S2 MolecularWeight: 521.65098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C27H27N3O4S2/c1-19-16-24-25(17-20(19)2)35-27(28-24)30(18-21-6-4-3-5-7-21)26(31)22-8-10-23(11-9-22)36(32,33)29-12-14-34-15-13-29/h3-11,16-17H,12-15,18H2,1-2H3