methyl N-(1-propanoyl-5-propylsulfanyl-benzimidazol-2-yl)carbamate

Systemtic Name: methyl N-(1-propanoyl-5-propylsulfanyl-benzimidazol-2-yl)carbamate Openeye Name: methyl N-(1-propanoyl-5-propylsulfanyl-benzimidazol-2-yl)carbamate CAS Name: N-[1-(1-oxopropyl)-5-(propylthio)-2-benzimidazolyl]carbamic acid methyl ester IUPAC Name: methyl N-(1-propanoyl-5-propylsulfanylbenzimidazol-2-yl)carbamate Traditional Name: N-[1-propionyl-5-(propylthio)benzimidazol-2-yl]carbamic acid methyl ester Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC2=C(C=C1)N(C(=N2)NC(=O)OC)C(=O)CC

Isomeric SMILES

CCCSC1=CC2=C(C=C1)N(C(=N2)NC(=O)OC)C(=O)CC

InChI

InChI=1S/C15H19N3O3S/c1-4-8-22-10-6-7-12-11(9-10)16-14(17-15(20)21-3)18(12)13(19)5-2/h6-7,9H,4-5,8H2,1-3H3,(H,16,17,20)