3-azanyl-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione

Systemtic Name: 3-azanyl-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione Openeye Name: 3-amino-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione CAS Name: 3-amino-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione IUPAC Name: 3-amino-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione Traditional Name: 3-amino-4-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-1-thione Formula: C22H18ClN3S2 MolecularWeight: 423.98142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(N(C2=S)C3=CC=C(C=C3)Cl)N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC2=C(C1)C(=C(N(C2=S)C3=CC=C(C=C3)Cl)N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H18ClN3S2/c23-13-9-11-14(12-10-13)26-20(24)19(15-5-1-2-6-16(15)22(26)27)21-25-17-7-3-4-8-18(17)28-21/h3-4,7-12H,1-2,5-6,24H2