N-[1-(1H-benzimidazol-2-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-5-methoxy-1-methyl-indole-2-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-ylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-5-methoxy-1-methyl-indole-2-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-ylcarbamoyl)-3-methylsulfanyl-propyl]-5-methoxy-1-methyl-indole-2-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-ylamino)-4-(methylthio)-1-oxobutan-2-yl]-5-methoxy-1-methyl-2-indolecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-ylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-5-methoxy-1-methylindole-2-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-ylcarbamoyl)-3-(methylthio)propyl]-5-methoxy-1-methyl-indole-2-carboxamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)NC(CCSC)C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C2=C(C=C(C=C2)OC)C=C1C(=O)NC(CCSC)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C23H25N5O3S/c1-28-19-9-8-15(31-2)12-14(19)13-20(28)22(30)24-18(10-11-32-3)21(29)27-23-25-16-6-4-5-7-17(16)26-23/h4-9,12-13,18H,10-11H2,1-3H3,(H,24,30)(H2,25,26,27,29)