(2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanamide

Systemtic Name: (2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanamide Openeye Name: (2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanamide CAS Name: (2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanamide IUPAC Name: (2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanamide Traditional Name: (2R)-N-(1-adamantyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propionamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(C)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)N[C@H](C)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H27N3OS/c1-12(22-17-3-4-18-19(8-17)26-13(2)23-18)20(25)24-21-9-14-5-15(10-21)7-16(6-14)11-21/h3-4,8,12,14-16,22H,5-7,9-11H2,1-2H3,(H,24,25)/t12-,14?,15?,16?,21?/m1/s1