N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloranyl-N-(phenylmethyl)propanamide

Systemtic Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloranyl-N-(phenylmethyl)propanamide Openeye Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloro-propanamide CAS Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-2-chloro-N-(phenylmethyl)propanamide IUPAC Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloropropanamide Traditional Name: N-[5-(1-adamantyl)-1,3,4-thiadiazol-2-yl]-N-benzyl-2-chloro-propionamide Formula: C22H26ClN3OS MolecularWeight: 415.97934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)C2=NN=C(S2)C34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

CC(C(=O)N(CC1=CC=CC=C1)C2=NN=C(S2)C34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C22H26ClN3OS/c1-14(23)19(27)26(13-15-5-3-2-4-6-15)21-25-24-20(28-21)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-6,14,16-18H,7-13H2,1H3