(2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)-(5-undec-1-ynylthiophen-2-yl)methanol

Systemtic Name: (2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)-(5-undec-1-ynylthiophen-2-yl)methanol Openeye Name: (2-phenyl-4,5-dihydrooxazol-4-yl)-(5-undec-1-ynyl-2-thienyl)methanol CAS Name: (2-phenyl-4,5-dihydrooxazol-4-yl)-(5-undec-1-ynyl-2-thiophenyl)methanol IUPAC Name: (2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)-(5-undec-1-ynylthiophen-2-yl)methanol Traditional Name: (2-phenyl-2-oxazolin-4-yl)-(5-undec-1-ynyl-2-thienyl)methanol Formula: C25H31NO2S MolecularWeight: 409.58414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC#CC1=CC=C(S1)C(C2COC(=N2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCCCCCC#CC1=CC=C(S1)C(C2COC(=N2)C3=CC=CC=C3)O

InChI

InChI=1S/C25H31NO2S/c1-2-3-4-5-6-7-8-9-13-16-21-17-18-23(29-21)24(27)22-19-28-25(26-22)20-14-11-10-12-15-20/h10-12,14-15,17-18,22,24,27H,2-9,19H2,1H3