3-[4-[(2S)-2-oxidanylpropyl]-1,2,3-triazol-1-yl]-6-(2-thiophen-3-ylethynyl)chromen-2-one

Systemtic Name: 3-[4-[(2S)-2-oxidanylpropyl]-1,2,3-triazol-1-yl]-6-(2-thiophen-3-ylethynyl)chromen-2-one Openeye Name: 3-[4-[(2S)-2-hydroxypropyl]triazol-1-yl]-6-[2-(3-thienyl)ethynyl]chromen-2-one CAS Name: 3-[4-[(2S)-2-hydroxypropyl]-1-triazolyl]-6-[2-(3-thiophenyl)ethynyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[(2S)-2-hydroxypropyl]triazol-1-yl]-6-(2-thiophen-3-ylethynyl)chromen-2-one Traditional Name: 3-[4-[(2S)-2-hydroxypropyl]triazol-1-yl]-6-[2-(3-thienyl)ethynyl]coumarin Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN(N=N1)C2=CC3=C(C=CC(=C3)C#CC4=CSC=C4)OC2=O)O

Isomeric SMILES

C[C@@H](CC1=CN(N=N1)C2=CC3=C(C=CC(=C3)C#CC4=CSC=C4)OC2=O)O

InChI

InChI=1S/C20H15N3O3S/c1-13(24)8-17-11-23(22-21-17)18-10-16-9-14(2-3-15-6-7-27-12-15)4-5-19(16)26-20(18)25/h4-7,9-13,24H,8H2,1H3/t13-/m0/s1