[4-[(3-methylphenyl)methyl]piperazin-1-yl]-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone

Systemtic Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: [4-(m-tolylmethyl)piperazin-1-yl]-[1-(2-naphthylsulfonyl)-4-piperidyl]methanone CAS Name: [4-[(3-methylphenyl)methyl]-1-piperazinyl]-[1-(2-naphthalenylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-(1-naphthalen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: [4-(3-methylbenzyl)piperazino]-[1-(2-naphthylsulfonyl)-4-piperidyl]methanone Formula: C28H33N3O3S MolecularWeight: 491.64492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H33N3O3S/c1-22-5-4-6-23(19-22)21-29-15-17-30(18-16-29)28(32)25-11-13-31(14-12-25)35(33,34)27-10-9-24-7-2-3-8-26(24)20-27/h2-10,19-20,25H,11-18,21H2,1H3