2-[[4-azanyl-2-[[4-(2-dimethylaminoethyloxy)phenyl]amino]-1,3-thiazol-5-yl]carbonyl]benzenecarbonitrile

Systemtic Name: 2-[[4-azanyl-2-[[4-(2-dimethylaminoethyloxy)phenyl]amino]-1,3-thiazol-5-yl]carbonyl]benzenecarbonitrile Openeye Name: 2-[4-amino-2-[4-(2-dimethylaminoethyloxy)anilino]thiazole-5-carbonyl]benzonitrile CAS Name: 2-[[4-amino-2-[4-(2-dimethylaminoethyloxy)anilino]-5-thiazolyl]-oxomethyl]benzonitrile IUPAC Name: 2-[4-amino-2-[4-(2-dimethylaminoethyloxy)anilino]-1,3-thiazole-5-carbonyl]benzonitrile Traditional Name: 2-[4-amino-2-[4-(2-dimethylaminoethyloxy)anilino]thiazole-5-carbonyl]benzonitrile Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)C3=CC=CC=C3C#N)N

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)C3=CC=CC=C3C#N)N

InChI

InChI=1S/C21H21N5O2S/c1-26(2)11-12-28-16-9-7-15(8-10-16)24-21-25-20(23)19(29-21)18(27)17-6-4-3-5-14(17)13-22/h3-10H,11-12,23H2,1-2H3,(H,24,25)