6-[(4R)-4-oxidanylpent-1-ynyl]-3-(4-thiophen-3-yl-1,2,3-triazol-1-yl)chromen-2-one

Systemtic Name: 6-[(4R)-4-oxidanylpent-1-ynyl]-3-(4-thiophen-3-yl-1,2,3-triazol-1-yl)chromen-2-one Openeye Name: 6-[(4R)-4-hydroxypent-1-ynyl]-3-[4-(3-thienyl)triazol-1-yl]chromen-2-one CAS Name: 6-[(4R)-4-hydroxypent-1-ynyl]-3-[4-(3-thiophenyl)-1-triazolyl]-1-benzopyran-2-one IUPAC Name: 6-[(4R)-4-hydroxypent-1-ynyl]-3-(4-thiophen-3-yltriazol-1-yl)chromen-2-one Traditional Name: 6-[(4R)-4-hydroxypent-1-ynyl]-3-[4-(3-thienyl)triazol-1-yl]coumarin Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#CC1=CC2=C(C=C1)OC(=O)C(=C2)N3C=C(N=N3)C4=CSC=C4)O

Isomeric SMILES

C[C@H](CC#CC1=CC2=C(C=C1)OC(=O)C(=C2)N3C=C(N=N3)C4=CSC=C4)O

InChI

InChI=1S/C20H15N3O3S/c1-13(24)3-2-4-14-5-6-19-16(9-14)10-18(20(25)26-19)23-11-17(21-22-23)15-7-8-27-12-15/h5-13,24H,3H2,1H3/t13-/m1/s1