1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione

Systemtic Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione Openeye Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione CAS Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione IUPAC Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione Traditional Name: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=S)N=C(N2CC3COC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=S)N=C(N2C[C@H]3COC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C23H22N2O2S/c28-23-18-10-4-5-11-19(18)25(22(24-23)16-8-2-1-3-9-16)14-17-15-26-20-12-6-7-13-21(20)27-17/h1-3,6-9,12-13,17H,4-5,10-11,14-15H2/t17-/m0/s1