(5E)-5-(3-azanyl-6-methyl-7-phenyl-4,5,6,7-tetrahydroisoindol-1-ylidene)-2-(2-butylphenyl)imino-1,3-thiazol-4-amine hydrochloride

Systemtic Name: (5E)-5-(3-azanyl-6-methyl-7-phenyl-4,5,6,7-tetrahydroisoindol-1-ylidene)-2-(2-butylphenyl)imino-1,3-thiazol-4-amine hydrochloride Openeye Name: (5E)-5-(3-amino-6-methyl-7-phenyl-4,5,6,7-tetrahydroisoindol-1-ylidene)-2-(2-butylphenyl)imino-thiazol-4-amine hydrochloride CAS Name: (5E)-5-(3-amino-6-methyl-7-phenyl-4,5,6,7-tetrahydroisoindol-1-ylidene)-2-(2-butylphenyl)imino-4-thiazolamine hydrochloride IUPAC Name: (5E)-5-(3-amino-6-methyl-7-phenyl-4,5,6,7-tetrahydroisoindol-1-ylidene)-2-(2-butylphenyl)imino-1,3-thiazol-4-amine hydrochloride Traditional Name: [(3E)-3-[4-amino-2-(2-butylphenyl)imino-3-thiazolin-5-ylidene]-5-methyl-4-phenyl-4,5,6,7-tetrahydroisoindol-1-yl]amine hydrochloride Formula: C28H32ClN5S MolecularWeight: 506.10518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1N=C2N=C(C(=C3C4=C(CCC(C4C5=CC=CC=C5)C)C(=N3)N)S2)N.Cl

Isomeric SMILES

CCCCC1=CC=CC=C1N=C2N=C(/C(=C\3/C4=C(CCC(C4C5=CC=CC=C5)C)C(=N3)N)/S2)N.Cl

InChI

InChI=1S/C28H31N5S.ClH/c1-3-4-10-18-11-8-9-14-21(18)31-28-33-27(30)25(34-28)24-23-20(26(29)32-24)16-15-17(2)22(23)19-12-6-5-7-13-19;/h5-9,11-14,17,22H,3-4,10,15-16H2,1-2H3,(H2,29,32)(H2,30,31,33);1H/b25-24+;