2-azanyl-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-2-methyl-butan-1-ol

Systemtic Name: 2-azanyl-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-2-methyl-butan-1-ol Openeye Name: 2-amino-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol CAS Name: 2-amino-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]-2-thiophenyl]-2-methyl-1-butanol IUPAC Name: 2-amino-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]thiophen-2-yl]-2-methylbutan-1-ol Traditional Name: 2-amino-4-[5-[3-(4-methoxyphenyl)pent-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC1=CC=C(S1)CCC(C)(CO)N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C#CC1=CC=C(S1)CCC(C)(CO)N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H27NO2S/c1-4-16(17-5-8-18(24-3)9-6-17)7-10-19-11-12-20(25-19)13-14-21(2,22)15-23/h5-6,8-9,11-12,16,23H,4,13-15,22H2,1-3H3