N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-(cyclopropylmethyl)-4-methylsulfonyl-benzamide

Systemtic Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-(cyclopropylmethyl)-4-methylsulfonyl-benzamide Openeye Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-N-(cyclopropylmethyl)-4-methylsulfonyl-benzamide CAS Name: N-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-N-(cyclopropylmethyl)-4-methylsulfonylbenzamide IUPAC Name: N-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-N-(cyclopropylmethyl)-4-methylsulfonylbenzamide Traditional Name: N-[1-(3-cyanobenzyl)-4-piperidyl]-N-(cyclopropylmethyl)-4-mesyl-benzamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N(CC2CC2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N(CC2CC2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H29N3O3S/c1-32(30,31)24-9-7-22(8-10-24)25(29)28(18-19-5-6-19)23-11-13-27(14-12-23)17-21-4-2-3-20(15-21)16-26/h2-4,7-10,15,19,23H,5-6,11-14,17-18H2,1H3