4-(indol-3-ylidenemethylamino)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazolidine-3-thiol

Systemtic Name: 4-(indol-3-ylidenemethylamino)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazolidine-3-thiol Openeye Name: 4-(indol-3-ylidenemethylamino)-5-(3-isopropoxyphenyl)-1,2,4-triazolidine-3-thiol CAS Name: 4-(3-indolylidenemethylamino)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazolidine-3-thiol IUPAC Name: 4-(indol-3-ylidenemethylamino)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazolidine-3-thiol Traditional Name: 4-(indol-3-ylidenemethylamino)-5-(3-isopropoxyphenyl)-1,2,4-triazolidine-3-thiol Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2NNC(N2NC=C3C=NC4=CC=CC=C43)S

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2NNC(N2NC=C3C=NC4=CC=CC=C43)S

InChI

InChI=1S/C20H23N5OS/c1-13(2)26-16-7-5-6-14(10-16)19-23-24-20(27)25(19)22-12-15-11-21-18-9-4-3-8-17(15)18/h3-13,19-20,22-24,27H,1-2H3