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

Systemtic Name: 4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-thiophen-3-yl-quinazoline Openeye Name: 4-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(3-thienyl)quinazoline CAS Name: 4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-2-(3-thiophenyl)quinazoline IUPAC Name: 4-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-2-thiophen-3-ylquinazoline Traditional Name: 4-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-2-(3-thienyl)quinazoline Formula: C22H16N6S2 MolecularWeight: 428.53264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C5=CSC=C5)C6=CC=NC=C6

Isomeric SMILES

C1CC1N2C(=NN=C2SC3=NC(=NC4=CC=CC=C43)C5=CSC=C5)C6=CC=NC=C6

InChI

InChI=1S/C22H16N6S2/c1-2-4-18-17(3-1)21(25-19(24-18)15-9-12-29-13-15)30-22-27-26-20(28(22)16-5-6-16)14-7-10-23-11-8-14/h1-4,7-13,16H,5-6H2