N-phenethyl-2-pyridin-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-phenethyl-2-pyridin-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Openeye Name: N-phenethyl-2-(2-pyridyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-amine CAS Name: N-phenethyl-2-(2-pyridinyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-phenethyl-2-pyridin-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine Traditional Name: phenethyl-[2-(2-pyridyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl]amine Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=C(N=C3S2)C4=CC=CC=N4)NCCC5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=C(N=C3S2)C4=CC=CC=N4)NCCC5=CC=CC=C5

InChI

InChI=1S/C23H22N4S/c1-2-8-16(9-3-1)13-15-25-22-20-17-10-4-5-12-19(17)28-23(20)27-21(26-22)18-11-6-7-14-24-18/h1-3,6-9,11,14H,4-5,10,12-13,15H2,(H,25,26,27)