N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]-3-(4-ethanoylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]benzamide CAS Name: 3-[(4-acetyl-1-piperazinyl)sulfonyl]-N-[(1S)-1-(4-tert-butylphenyl)-2-methylpropyl]benzamide IUPAC Name: 3-(4-acetylpiperazin-1-yl)sulfonyl-N-[(1S)-1-(4-tert-butylphenyl)-2-methylpropyl]benzamide Traditional Name: 3-(4-acetylpiperazino)sulfonyl-N-[(1S)-1-(4-tert-butylphenyl)-2-methyl-propyl]benzamide Formula: C27H37N3O4S MolecularWeight: 499.66538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C1=CC=C(C=C1)C(C)(C)C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C27H37N3O4S/c1-19(2)25(21-10-12-23(13-11-21)27(4,5)6)28-26(32)22-8-7-9-24(18-22)35(33,34)30-16-14-29(15-17-30)20(3)31/h7-13,18-19,25H,14-17H2,1-6H3,(H,28,32)/t25-/m0/s1