(2R)-N-(4-morpholin-4-ylphenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-morpholin-4-ylphenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-2-(1-allylbenzimidazol-2-yl)sulfanyl-N-(4-morpholinophenyl)propanamide CAS Name: (2R)-N-[4-(4-morpholinyl)phenyl]-2-[(1-prop-2-enyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-(4-morpholin-4-ylphenyl)-2-(1-prop-2-enylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-2-[(1-allylbenzimidazol-2-yl)thio]-N-(4-morpholinophenyl)propionamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NC4=CC=CC=C4N3CC=C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)SC3=NC4=CC=CC=C4N3CC=C

InChI

InChI=1S/C23H26N4O2S/c1-3-12-27-21-7-5-4-6-20(21)25-23(27)30-17(2)22(28)24-18-8-10-19(11-9-18)26-13-15-29-16-14-26/h3-11,17H,1,12-16H2,2H3,(H,24,28)/t17-/m1/s1