N-[(2S)-1-(cyclohexylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide

Systemtic Name: N-[(2S)-1-(cyclohexylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide Openeye Name: N-[(1S)-1-(cyclohexylcarbamoyl)-3-methylsulfanyl-propyl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide CAS Name: N-[(2S)-1-(cyclohexylamino)-4-(methylthio)-1-oxobutan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide IUPAC Name: N-[(2S)-1-(cyclohexylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide Traditional Name: N-[(1S)-1-(cyclohexylcarbamoyl)-3-(methylthio)propyl]-1,2-dihydroimidazo[1,2-a]benzimidazole-3-carboxamide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1CCCCC1)NC(=O)N2CCN3C2=NC4=CC=CC=C43

Isomeric SMILES

CSCC[C@@H](C(=O)NC1CCCCC1)NC(=O)N2CCN3C2=NC4=CC=CC=C43

InChI

InChI=1S/C21H29N5O2S/c1-29-14-11-17(19(27)22-15-7-3-2-4-8-15)24-21(28)26-13-12-25-18-10-6-5-9-16(18)23-20(25)26/h5-6,9-10,15,17H,2-4,7-8,11-14H2,1H3,(H,22,27)(H,24,28)/t17-/m0/s1