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

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]piperidin-4-yl]benzamide Openeye Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]-4-piperidyl]benzamide CAS Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(1H-1,2,4-triazol-5-ylthio)propyl]-4-piperidinyl]benzamide IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(1H-1,2,4-triazol-5-ylsulfanyl)propyl]piperidin-4-yl]benzamide Traditional Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(1H-1,2,4-triazol-5-ylthio)propyl]-4-piperidyl]benzamide Formula: C19H27ClN6O3S MolecularWeight: 454.97408

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCSC3=NC=NN3

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCSC3=NC=NN3

InChI

InChI=1S/C19H27ClN6O3S/c1-28-16-9-14(21)13(20)8-12(16)18(27)24-15-4-6-26(10-17(15)29-2)5-3-7-30-19-22-11-23-25-19/h8-9,11,15,17H,3-7,10,21H2,1-2H3,(H,24,27)(H,22,23,25)