2-methoxy-6-[[[3-(3-propan-2-yloxyphenyl)-5-sulfanyl-1,2,4-triazolidin-4-yl]amino]methyl]phenol

Systemtic Name: 2-methoxy-6-[[[3-(3-propan-2-yloxyphenyl)-5-sulfanyl-1,2,4-triazolidin-4-yl]amino]methyl]phenol Openeye Name: 2-[[[3-(3-isopropoxyphenyl)-5-sulfanyl-1,2,4-triazolidin-4-yl]amino]methyl]-6-methoxy-phenol CAS Name: 2-[[[3-mercapto-5-(3-propan-2-yloxyphenyl)-1,2,4-triazolidin-4-yl]amino]methyl]-6-methoxyphenol IUPAC Name: 2-methoxy-6-[[[3-(3-propan-2-yloxyphenyl)-5-sulfanyl-1,2,4-triazolidin-4-yl]amino]methyl]phenol Traditional Name: 2-[[[3-(3-isopropoxyphenyl)-5-mercapto-1,2,4-triazolidin-4-yl]amino]methyl]-6-methoxy-phenol Formula: C19H26N4O3S MolecularWeight: 390.49974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2NNC(N2NCC3=C(C(=CC=C3)OC)O)S

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2NNC(N2NCC3=C(C(=CC=C3)OC)O)S

InChI

InChI=1S/C19H26N4O3S/c1-12(2)26-15-8-4-6-13(10-15)18-21-22-19(27)23(18)20-11-14-7-5-9-16(25-3)17(14)24/h4-10,12,18-22,24,27H,11H2,1-3H3