4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]piperidin-4-yl]benzamide

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylthio)ethyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethyl]piperidin-4-yl]benzamide Traditional Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[2-(1H-1,2,4-triazol-5-ylthio)ethyl]-4-piperidyl]benzamide Formula: C18H25ClN6O3S MolecularWeight: 440.9475

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCSC3=NC=NN3

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCSC3=NC=NN3

InChI

InChI=1S/C18H25ClN6O3S/c1-27-15-8-13(20)12(19)7-11(15)17(26)23-14-3-4-25(9-16(14)28-2)5-6-29-18-21-10-22-24-18/h7-8,10,14,16H,3-6,9,20H2,1-2H3,(H,23,26)(H,21,22,24)