N-tert-butyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-tert-butyl-N-[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-N-tert-butyl-adamantane-1-carboxamide CAS Name: N-tert-butyl-N-[2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-N-tert-butyladamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-N-tert-butyl-adamantane-1-carboxamide Formula: C30H40N2O2S MolecularWeight: 492.7158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C(=O)C34CC5CC(C3)CC(C5)C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)CN(C(=O)C34CC5CC(C3)CC(C5)C4)C(C)(C)C

InChI

InChI=1S/C30H40N2O2S/c1-21-10-11-26(35-21)19-31(18-22-8-6-5-7-9-22)27(33)20-32(29(2,3)4)28(34)30-15-23-12-24(16-30)14-25(13-23)17-30/h5-11,23-25H,12-20H2,1-4H3