7-methyl-N-(4-pentoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 7-methyl-N-(4-pentoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Openeye Name: 7-methyl-N-(4-pentoxyphenyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine CAS Name: 7-methyl-N-(4-pentoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine IUPAC Name: 7-methyl-N-(4-pentoxyphenyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Traditional Name: (4-amoxyphenyl)-(7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)amine Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC2=C3C4=C(CC(CC4)C)SC3=NC=N2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC2=C3C4=C(CC(CC4)C)SC3=NC=N2

InChI

InChI=1S/C22H27N3OS/c1-3-4-5-12-26-17-9-7-16(8-10-17)25-21-20-18-11-6-15(2)13-19(18)27-22(20)24-14-23-21/h7-10,14-15H,3-6,11-13H2,1-2H3,(H,23,24,25)