N-tert-butyl-2-[[1-(3-butyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)-1-oxidanylidene-propan-2-yl]amino]naphthalene-1-carboxamide

Systemtic Name: N-tert-butyl-2-[[1-(3-butyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)-1-oxidanylidene-propan-2-yl]amino]naphthalene-1-carboxamide Openeye Name: N-tert-butyl-2-[[2-[3-butyl-4-(2-naphthylsulfonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl]amino]naphthalene-1-carboxamide CAS Name: N-tert-butyl-2-[[1-[3-butyl-4-(2-naphthalenylsulfonyl)-1-piperazinyl]-1-oxopropan-2-yl]amino]-1-naphthalenecarboxamide IUPAC Name: N-tert-butyl-2-[[1-(3-butyl-4-naphthalen-2-ylsulfonylpiperazin-1-yl)-1-oxopropan-2-yl]amino]naphthalene-1-carboxamide Traditional Name: N-tert-butyl-2-[[2-[3-butyl-4-(2-naphthylsulfonyl)piperazino]-2-keto-1-methyl-ethyl]amino]-1-naphthamide Formula: C36H44N4O4S MolecularWeight: 628.82396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C(C)NC4=C(C5=CC=CC=C5C=C4)C(=O)NC(C)(C)C

Isomeric SMILES

CCCCC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C(C)NC4=C(C5=CC=CC=C5C=C4)C(=O)NC(C)(C)C

InChI

InChI=1S/C36H44N4O4S/c1-6-7-15-29-24-39(21-22-40(29)45(43,44)30-19-17-26-12-8-9-14-28(26)23-30)35(42)25(2)37-32-20-18-27-13-10-11-16-31(27)33(32)34(41)38-36(3,4)5/h8-14,16-20,23,25,29,37H,6-7,15,21-22,24H2,1-5H3,(H,38,41)