4-chloranyl-6-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-[[(3-cyclopropyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-[[(3-cyclopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C12H11ClN4OS MolecularWeight: 294.75994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NNC(=S)N2NC=C3C=C(C=CC3=O)Cl

Isomeric SMILES

C1CC1C2=NNC(=S)N2NC=C3C=C(C=CC3=O)Cl

InChI

InChI=1S/C12H11ClN4OS/c13-9-3-4-10(18)8(5-9)6-14-17-11(7-1-2-7)15-16-12(17)19/h3-7,14H,1-2H2,(H,16,19)