4-[(2-azanyl-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methylpiperidin-1-yl)propoxy]quinoline-3-carbonitrile

Systemtic Name: 4-[(2-azanyl-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methylpiperidin-1-yl)propoxy]quinoline-3-carbonitrile Openeye Name: 4-[(2-amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methyl-1-piperidyl)propoxy]quinoline-3-carbonitrile CAS Name: 4-[(2-amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methyl-1-piperidinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 4-[(2-amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methylpiperidin-1-yl)propoxy]quinoline-3-carbonitrile Traditional Name: 4-[(2-amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[3-(4-methylpiperidino)propoxy]quinoline-3-carbonitrile Formula: C27H30N6OS MolecularWeight: 486.6317

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=CC5=C(C=C4)N=C(S5)N)C#N)C

Isomeric SMILES

CC1CCN(CC1)CCCOC2=C(C=C3C(=C2)N=CC(=C3NC4=CC5=C(C=C4)N=C(S5)N)C#N)C

InChI

InChI=1S/C27H30N6OS/c1-17-6-9-33(10-7-17)8-3-11-34-24-14-23-21(12-18(24)2)26(19(15-28)16-30-23)31-20-4-5-22-25(13-20)35-27(29)32-22/h4-5,12-14,16-17H,3,6-11H2,1-2H3,(H2,29,32)(H,30,31)