N-[4-[4-azanyl-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[4-[4-azanyl-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-1,3-benzothiazol-2-amine Openeye Name: N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-1,3-benzothiazol-2-amine CAS Name: N-[4-[4-amino-7-[4-(4-methyl-1-piperazinyl)cyclohexyl]-5-pyrrolo[2,3-d]pyrimidinyl]phenyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[4-[4-amino-7-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-1,3-benzothiazol-2-amine Traditional Name: [4-[4-amino-7-[4-(4-methylpiperazino)cyclohexyl]pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]-(1,3-benzothiazol-2-yl)amine Formula: C30H34N8S MolecularWeight: 538.70956

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC=C(C=C5)NC6=NC7=CC=CC=C7S6

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)N3C=C(C4=C3N=CN=C4N)C5=CC=C(C=C5)NC6=NC7=CC=CC=C7S6

InChI

InChI=1S/C30H34N8S/c1-36-14-16-37(17-15-36)22-10-12-23(13-11-22)38-18-24(27-28(31)32-19-33-29(27)38)20-6-8-21(9-7-20)34-30-35-25-4-2-3-5-26(25)39-30/h2-9,18-19,22-23H,10-17H2,1H3,(H,34,35)(H2,31,32,33)