3-methyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]benzamide

Systemtic Name: 3-methyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]benzamide Openeye Name: N-[3-(4-benzylpiperazine-1-carbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]-3-methyl-benzamide CAS Name: 3-methyl-N-[3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]benzamide IUPAC Name: N-[3-(4-benzylpiperazine-1-carbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]-3-methylbenzamide Traditional Name: N-[3-(4-benzylpiperazine-1-carbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]-3-methyl-benzamide Formula: C29H33N3O2S MolecularWeight: 487.65622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N3O2S/c1-21-9-8-12-23(19-21)27(33)30-28-26(24-13-6-3-7-14-25(24)35-28)29(34)32-17-15-31(16-18-32)20-22-10-4-2-5-11-22/h2,4-5,8-12,19H,3,6-7,13-18,20H2,1H3,(H,30,33)