4-[(2R)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[(2R)-2-(5-chloranyl-1-propyl-benzimidazol-2-yl)sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[(2R)-2-(5-chloro-1-propyl-benzimidazol-2-yl)sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[(2R)-2-[(5-chloro-1-propyl-2-benzimidazolyl)thio]-1-oxopropyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[(2R)-2-(5-chloro-1-propylbenzimidazol-2-yl)sulfanylpropanoyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[(2R)-2-[(5-chloro-1-propyl-benzimidazol-2-yl)thio]propanoyl]-1,3-dihydroquinoxalin-2-one Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)N3CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)Cl)N=C1S[C@H](C)C(=O)N3CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C21H21ClN4O2S/c1-3-10-25-18-9-8-14(22)11-16(18)24-21(25)29-13(2)20(28)26-12-19(27)23-15-6-4-5-7-17(15)26/h4-9,11,13H,3,10,12H2,1-2H3,(H,23,27)/t13-/m1/s1