2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-cyano-1-propyl-piperidin-4-yl)-3-cyclohexyl-propanamide

Systemtic Name: 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-N-(4-cyano-1-propyl-piperidin-4-yl)-3-cyclohexyl-propanamide Openeye Name: N-(4-cyano-1-propyl-4-piperidyl)-3-cyclohexyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide CAS Name: N-(4-cyano-1-propyl-4-piperidinyl)-3-cyclohexyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide IUPAC Name: N-(4-cyano-1-propylpiperidin-4-yl)-3-cyclohexyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanamide Traditional Name: N-(4-cyano-1-propyl-4-piperidyl)-3-cyclohexyl-2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionamide Formula: C25H35N5O3S MolecularWeight: 485.6421

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C25H35N5O3S/c1-2-14-30-15-12-25(18-26,13-16-30)28-24(31)21(17-19-8-4-3-5-9-19)27-23-20-10-6-7-11-22(20)34(32,33)29-23/h6-7,10-11,19,21H,2-5,8-9,12-17H2,1H3,(H,27,29)(H,28,31)