N-[4-methyl-1-[[2-methyl-1-[3-methylbut-2-enyl-(4-methylphenyl)amino]propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide

Systemtic Name: N-[4-methyl-1-[[2-methyl-1-[3-methylbut-2-enyl-(4-methylphenyl)amino]propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]azepane-1-carboxamide Openeye Name: N-[1-[[1,1-dimethyl-2-[4-methyl-N-(3-methylbut-2-enyl)anilino]ethyl]carbamoyl]-3-methyl-butyl]azepane-1-carboxamide CAS Name: N-[4-methyl-1-[[2-methyl-1-[4-methyl-N-(3-methylbut-2-enyl)anilino]propan-2-yl]amino]-1-oxopentan-2-yl]-1-azepanecarboxamide IUPAC Name: N-[4-methyl-1-[[2-methyl-1-[4-methyl-N-(3-methylbut-2-enyl)anilino]propan-2-yl]amino]-1-oxopentan-2-yl]azepane-1-carboxamide Traditional Name: N-[1-[[1,1-dimethyl-2-[4-methyl-N-(3-methylbut-2-enyl)anilino]ethyl]carbamoyl]-3-methyl-butyl]azepane-1-carboxamide Formula: C29H48N4O2 MolecularWeight: 484.71702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC=C(C)C)CC(C)(C)NC(=O)C(CC(C)C)NC(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)N(CC=C(C)C)CC(C)(C)NC(=O)C(CC(C)C)NC(=O)N2CCCCCC2

InChI

InChI=1S/C29H48N4O2/c1-22(2)16-19-33(25-14-12-24(5)13-15-25)21-29(6,7)31-27(34)26(20-23(3)4)30-28(35)32-17-10-8-9-11-18-32/h12-16,23,26H,8-11,17-21H2,1-7H3,(H,30,35)(H,31,34)