(3E)-3-(4-azanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)isoindol-1-amine hydrochloride

Systemtic Name: (3E)-3-(4-azanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)isoindol-1-amine hydrochloride Openeye Name: (3E)-3-[4-imino-2-(1-piperidyl)thiazol-5-ylidene]isoindol-1-amine hydrochloride CAS Name: (3E)-3-[4-imino-2-(1-piperidinyl)-5-thiazolylidene]-1-isoindolamine hydrochloride IUPAC Name: (3E)-3-(4-imino-2-piperidin-1-yl-1,3-thiazol-5-ylidene)isoindol-1-amine hydrochloride Traditional Name: [(3E)-3-(4-imino-2-piperidino-2-thiazolin-5-ylidene)isoindol-1-yl]amine hydrochloride Formula: C16H18ClN5S MolecularWeight: 347.86562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=N)C(=C3C4=CC=CC=C4C(=N3)N)S2.Cl

Isomeric SMILES

C1CCN(CC1)C2=NC(=N)/C(=C\3/C4=CC=CC=C4C(=N3)N)/S2.Cl

InChI

InChI=1S/C16H17N5S.ClH/c17-14-11-7-3-2-6-10(11)12(19-14)13-15(18)20-16(22-13)21-8-4-1-5-9-21;/h2-3,6-7,18H,1,4-5,8-9H2,(H2,17,19);1H/b13-12+,18-15?;