2-[4-(2-azanylidene-6-chloranyl-3-methyl-1,3-benzothiazol-4-yl)-2-(4-methylphenyl)piperidin-1-yl]ethanal

Systemtic Name: 2-[4-(2-azanylidene-6-chloranyl-3-methyl-1,3-benzothiazol-4-yl)-2-(4-methylphenyl)piperidin-1-yl]ethanal Openeye Name: 2-[4-(6-chloro-2-imino-3-methyl-1,3-benzothiazol-4-yl)-2-(p-tolyl)-1-piperidyl]acetaldehyde CAS Name: 2-[4-(6-chloro-2-imino-3-methyl-1,3-benzothiazol-4-yl)-2-(4-methylphenyl)-1-piperidinyl]acetaldehyde IUPAC Name: 2-[4-(6-chloro-2-imino-3-methyl-1,3-benzothiazol-4-yl)-2-(4-methylphenyl)piperidin-1-yl]acetaldehyde Traditional Name: 2-[4-(6-chloro-2-imino-3-methyl-1,3-benzothiazol-4-yl)-2-(p-tolyl)piperidino]acetaldehyde Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(CCN2CC=O)C3=CC(=CC4=C3N(C(=N)S4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(CCN2CC=O)C3=CC(=CC4=C3N(C(=N)S4)C)Cl

InChI

InChI=1S/C22H24ClN3OS/c1-14-3-5-15(6-4-14)19-11-16(7-8-26(19)9-10-27)18-12-17(23)13-20-21(18)25(2)22(24)28-20/h3-6,10,12-13,16,19,24H,7-9,11H2,1-2H3