N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-2-(benzotriazol-1-yl)ethanamide

Systemtic Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-2-(benzotriazol-1-yl)ethanamide Openeye Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-2-(benzotriazol-1-yl)acetamide CAS Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-2-(1-benzotriazolyl)acetamide IUPAC Name: N-[(Z)-1-(1-adamantyl)propan-2-ylideneamino]-2-(benzotriazol-1-yl)acetamide Traditional Name: N-[(Z)-[2-(1-adamantyl)-1-methyl-ethylidene]amino]-2-(benzotriazol-1-yl)acetamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1C2=CC=CC=C2N=N1)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=N/NC(=O)CN1C2=CC=CC=C2N=N1)/CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H27N5O/c1-14(9-21-10-15-6-16(11-21)8-17(7-15)12-21)22-24-20(27)13-26-19-5-3-2-4-18(19)23-25-26/h2-5,15-17H,6-13H2,1H3,(H,24,27)/b22-14-