N-[2-(2-adamantylamino)-2-oxidanylidene-ethyl]-3-carbamimidoyl-N-phenyl-benzamide

Systemtic Name: N-[2-(2-adamantylamino)-2-oxidanylidene-ethyl]-3-carbamimidoyl-N-phenyl-benzamide Openeye Name: N-[2-(2-adamantylamino)-2-oxo-ethyl]-3-carbamimidoyl-N-phenyl-benzamide CAS Name: N-[2-(2-adamantylamino)-2-oxoethyl]-3-carbamimidoyl-N-phenylbenzamide IUPAC Name: N-[2-(2-adamantylamino)-2-oxoethyl]-3-carbamimidoyl-N-phenylbenzamide Traditional Name: N-[2-(2-adamantylamino)-2-keto-ethyl]-3-amidino-N-phenyl-benzamide Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)CN(C4=CC=CC=C4)C(=O)C5=CC=CC(=C5)C(=N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)CN(C4=CC=CC=C4)C(=O)C5=CC=CC(=C5)C(=N)N

InChI

InChI=1S/C26H30N4O2/c27-25(28)18-5-4-6-19(14-18)26(32)30(22-7-2-1-3-8-22)15-23(31)29-24-20-10-16-9-17(12-20)13-21(24)11-16/h1-8,14,16-17,20-21,24H,9-13,15H2,(H3,27,28)(H,29,31)