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

Systemtic Name: 2-azanyl-4-[5-[5-(3,4-dimethoxyphenyl)pent-1-ynyl]thiophen-2-yl]-2-methyl-butan-1-ol Openeye Name: 2-amino-4-[5-[5-(3,4-dimethoxyphenyl)pent-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol CAS Name: 2-amino-4-[5-[5-(3,4-dimethoxyphenyl)pent-1-ynyl]-2-thiophenyl]-2-methyl-1-butanol IUPAC Name: 2-amino-4-[5-[5-(3,4-dimethoxyphenyl)pent-1-ynyl]thiophen-2-yl]-2-methylbutan-1-ol Traditional Name: 2-amino-4-[5-[5-(3,4-dimethoxyphenyl)pent-1-ynyl]-2-thienyl]-2-methyl-butan-1-ol Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)C#CCCCC2=CC(=C(C=C2)OC)OC)(CO)N

Isomeric SMILES

CC(CCC1=CC=C(S1)C#CCCCC2=CC(=C(C=C2)OC)OC)(CO)N

InChI

InChI=1S/C22H29NO3S/c1-22(23,16-24)14-13-19-11-10-18(27-19)8-6-4-5-7-17-9-12-20(25-2)21(15-17)26-3/h9-12,15,24H,4-5,7,13-14,16,23H2,1-3H3