4-cyclopenta-1,3-dien-1-yl-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione

Systemtic Name: 4-cyclopenta-1,3-dien-1-yl-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Openeye Name: 4-cyclopenta-1,3-dien-1-yl-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione CAS Name: 4-(1-cyclopenta-1,3-dienyl)-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione IUPAC Name: 4-cyclopenta-1,3-dien-1-yl-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Traditional Name: 4-cyclopenta-1,3-dien-1-yl-9-methoxy-3,4,5,6-tetrahydro-1H-benzo[h]quinazoline-2-thione Formula: C18H18N2OS MolecularWeight: 310.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCC3=C2NC(=S)NC3C4=CC=CC4)C=C1

Isomeric SMILES

COC1=CC2=C(CCC3=C2NC(=S)NC3C4=CC=CC4)C=C1

InChI

InChI=1S/C18H18N2OS/c1-21-13-8-6-11-7-9-14-16(12-4-2-3-5-12)19-18(22)20-17(14)15(11)10-13/h2-4,6,8,10,16H,5,7,9H2,1H3,(H2,19,20,22)