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2-[2-(dicyclohexylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

2-[2-(dicyclohexylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name:2-[2-(dicyclohexylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate
Openeye Name:2-[2-(dicyclohexylamino)-2-oxo-ethyl]sulfanylquinazolin-4-olate
CAS Name:2-[[2-(dicyclohexylamino)-2-oxoethyl]thio]-4-quinazolinolate
IUPAC Name:2-[2-(dicyclohexylamino)-2-oxoethyl]sulfanylquinazolin-4-olate
Traditional Name:2-[[2-(dicyclohexylamino)-2-keto-ethyl]thio]quinazolin-4-olate
Formula: C22H28N3O2S-
MolecularWeight: 398.54162
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]


Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)CSC3=NC4=CC=CC=C4C(=N3)[O-]


InChI

InChI=1S/C22H29N3O2S/c26-20(15-28-22-23-19-14-8-7-13-18(19)21(27)24-22)25(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h7-8,13-14,16-17H,1-6,9-12,15H2,(H,23,24,27)/p-1


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