4-[4-cyclopropyl-5-(2-thiophen-3-ylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine

Systemtic Name: 4-[4-cyclopropyl-5-(2-thiophen-3-ylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Openeye Name: 4-[4-cyclopropyl-5-[2-(3-thienyl)quinazolin-4-yl]sulfanyl-1,2,4-triazol-3-yl]morpholine CAS Name: 4-[4-cyclopropyl-5-[[2-(3-thiophenyl)-4-quinazolinyl]thio]-1,2,4-triazol-3-yl]morpholine IUPAC Name: 4-[4-cyclopropyl-5-(2-thiophen-3-ylquinazolin-4-yl)sulfanyl-1,2,4-triazol-3-yl]morpholine Traditional Name: 4-[4-cyclopropyl-5-[[2-(3-thienyl)quinazolin-4-yl]thio]-1,2,4-triazol-3-yl]morpholine Formula: C21H20N6OS2 MolecularWeight: 436.5531

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C5=CSC=C5)N6CCOCC6

Isomeric SMILES

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C5=CSC=C5)N6CCOCC6

InChI

InChI=1S/C21H20N6OS2/c1-2-4-17-16(3-1)19(23-18(22-17)14-7-12-29-13-14)30-21-25-24-20(27(21)15-5-6-15)26-8-10-28-11-9-26/h1-4,7,12-13,15H,5-6,8-11H2