N-[(2-cyanophenyl)carbamoyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-[(2-cyanophenyl)carbamoyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Openeye Name: N-[(2-cyanophenyl)carbamoyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide CAS Name: N-[(2-cyanoanilino)-oxomethyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]propanamide IUPAC Name: N-[(2-cyanophenyl)carbamoyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]propanamide Traditional Name: N-[(2-cyanophenyl)carbamoyl]-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]propionamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)NC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C20H19N5O3S/c1-3-28-14-8-9-16-17(10-14)24-20(23-16)29-12(2)18(26)25-19(27)22-15-7-5-4-6-13(15)11-21/h4-10,12H,3H2,1-2H3,(H,23,24)(H2,22,25,26,27)