N-(4-phenylazanylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-(4-phenylazanylphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(4-anilinophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(4-anilinophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(4-anilinophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(4-anilinophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C22H21N3S MolecularWeight: 359.48724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=S)NC3=CC=C(C=C3)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=S)NC3=CC=C(C=C3)NC4=CC=CC=C4

InChI

InChI=1S/C22H21N3S/c26-22(25-15-14-17-6-4-5-7-18(17)16-25)24-21-12-10-20(11-13-21)23-19-8-2-1-3-9-19/h1-13,23H,14-16H2,(H,24,26)