N-[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]-3-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]-3-(1,2,4-triazol-4-yl)benzamide Openeye Name: N-[(3S)-1-(cyclohexylmethyl)-3-piperidyl]-3-(1,2,4-triazol-4-yl)benzamide CAS Name: N-[(3S)-1-(cyclohexylmethyl)-3-piperidinyl]-3-(1,2,4-triazol-4-yl)benzamide IUPAC Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-3-yl]-3-(1,2,4-triazol-4-yl)benzamide Traditional Name: N-[(3S)-1-(cyclohexylmethyl)-3-piperidyl]-3-(1,2,4-triazol-4-yl)benzamide Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCCC(C2)NC(=O)C3=CC(=CC=C3)N4C=NN=C4

Isomeric SMILES

C1CCC(CC1)CN2CCC[C@@H](C2)NC(=O)C3=CC(=CC=C3)N4C=NN=C4

InChI

InChI=1S/C21H29N5O/c27-21(18-8-4-10-20(12-18)26-15-22-23-16-26)24-19-9-5-11-25(14-19)13-17-6-2-1-3-7-17/h4,8,10,12,15-17,19H,1-3,5-7,9,11,13-14H2,(H,24,27)/t19-/m0/s1