(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl (E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl (E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl (E)-3-(2-methylthiazol-4-yl)prop-2-enoate CAS Name: (E)-3-(2-methyl-4-thiazolyl)-2-propenoic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl (E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(2-methylthiazol-4-yl)acrylic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C22H26N4O5S2 MolecularWeight: 490.59564

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)C=CC4=CSC(=N4)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1COC(=O)/C=C/C4=CSC(=N4)C

InChI

InChI=1S/C22H26N4O5S2/c1-3-8-26-20-6-5-18(33(28,29)25-9-11-30-12-10-25)13-19(20)24-21(26)14-31-22(27)7-4-17-15-32-16(2)23-17/h4-7,13,15H,3,8-12,14H2,1-2H3/b7-4+