N1-[5-[(E)-2-(2-azanyl-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]-4-piperazin-1-ylsulfonyl-benzene-1,3-diamine

Systemtic Name: N1-[5-[(E)-2-(2-azanyl-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]-4-piperazin-1-ylsulfonyl-benzene-1,3-diamine Openeye Name: N1-[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)vinyl]pyrimidin-2-yl]-4-piperazin-1-ylsulfonyl-benzene-1,3-diamine CAS Name: N1-[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]-2-pyrimidinyl]-4-(1-piperazinylsulfonyl)benzene-1,3-diamine IUPAC Name: 1-N-[5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)ethenyl]pyrimidin-2-yl]-4-piperazin-1-ylsulfonylbenzene-1,3-diamine Traditional Name: [5-[(E)-2-(2-amino-1,3-benzothiazol-6-yl)vinyl]pyrimidin-2-yl]-(3-amino-4-piperazinosulfonyl-phenyl)amine Formula: C23H24N8O2S2 MolecularWeight: 508.61906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=C(C=C(C=C2)NC3=NC=C(C=N3)C=CC4=CC5=C(C=C4)N=C(S5)N)N

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=C(C=C(C=C2)NC3=NC=C(C=N3)/C=C/C4=CC5=C(C=C4)N=C(S5)N)N

InChI

InChI=1S/C23H24N8O2S2/c24-18-12-17(4-6-21(18)35(32,33)31-9-7-26-8-10-31)29-23-27-13-16(14-28-23)2-1-15-3-5-19-20(11-15)34-22(25)30-19/h1-6,11-14,26H,7-10,24H2,(H2,25,30)(H,27,28,29)/b2-1+