N-(1-adamantyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(1-adamantyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(1-adamantyl)-2-(1-ethylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(1-adamantyl)-2-[(1-ethyl-2-benzimidazolyl)thio]propanamide IUPAC Name: N-(1-adamantyl)-2-(1-ethylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(1-adamantyl)-2-[(1-ethylbenzimidazol-2-yl)thio]propionamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SC(C)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29N3OS/c1-3-25-19-7-5-4-6-18(19)23-21(25)27-14(2)20(26)24-22-11-15-8-16(12-22)10-17(9-15)13-22/h4-7,14-17H,3,8-13H2,1-2H3,(H,24,26)