3-(4-ethylphenyl)sulfonyl-5-pyrrolidin-1-yl-[1,2,3]triazolo[1,5-a]quinazoline

Systemtic Name: 3-(4-ethylphenyl)sulfonyl-5-pyrrolidin-1-yl-[1,2,3]triazolo[1,5-a]quinazoline Openeye Name: 3-(4-ethylphenyl)sulfonyl-5-pyrrolidin-1-yl-triazolo[1,5-a]quinazoline CAS Name: 3-(4-ethylphenyl)sulfonyl-5-(1-pyrrolidinyl)triazolo[1,5-a]quinazoline IUPAC Name: 3-(4-ethylphenyl)sulfonyl-5-pyrrolidin-1-yltriazolo[1,5-a]quinazoline Traditional Name: 3-(4-ethylphenyl)sulfonyl-5-pyrrolidino-triazolo[1,5-a]quinazoline Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=CC=CC=C4N3N=N2)N5CCCC5

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2=C3N=C(C4=CC=CC=C4N3N=N2)N5CCCC5

InChI

InChI=1S/C21H21N5O2S/c1-2-15-9-11-16(12-10-15)29(27,28)21-20-22-19(25-13-5-6-14-25)17-7-3-4-8-18(17)26(20)24-23-21/h3-4,7-12H,2,5-6,13-14H2,1H3