(3Z)-3-(4-azanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)-7-methyl-4-propan-2-yl-isoindol-1-amine hydrochloride

Systemtic Name: (3Z)-3-(4-azanylidene-2-piperidin-1-yl-1,3-thiazol-5-ylidene)-7-methyl-4-propan-2-yl-isoindol-1-amine hydrochloride Openeye Name: (3Z)-3-[4-imino-2-(1-piperidyl)thiazol-5-ylidene]-4-isopropyl-7-methyl-isoindol-1-amine hydrochloride CAS Name: (3Z)-3-[4-imino-2-(1-piperidinyl)-5-thiazolylidene]-7-methyl-4-propan-2-yl-1-isoindolamine hydrochloride IUPAC Name: (3Z)-3-(4-imino-2-piperidin-1-yl-1,3-thiazol-5-ylidene)-7-methyl-4-propan-2-ylisoindol-1-amine hydrochloride Traditional Name: [(3Z)-3-(4-imino-2-piperidino-2-thiazolin-5-ylidene)-4-isopropyl-7-methyl-isoindol-1-yl]amine hydrochloride Formula: C20H26ClN5S MolecularWeight: 403.97194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C(C)C)C(=C3C(=N)N=C(S3)N4CCCCC4)N=C2N.Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)C(C)C)/C(=C/3\C(=N)N=C(S3)N4CCCCC4)/N=C2N.Cl

InChI

InChI=1S/C20H25N5S.ClH/c1-11(2)13-8-7-12(3)14-15(13)16(23-18(14)21)17-19(22)24-20(26-17)25-9-5-4-6-10-25;/h7-8,11,22H,4-6,9-10H2,1-3H3,(H2,21,23);1H/b17-16-,22-19?;