4-[[5-(4-chlorophenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]butanoate

Systemtic Name: 4-[[5-(4-chlorophenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]butanoate Openeye Name: 4-[[5-(4-chlorophenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]butanoate CAS Name: 4-[[5-(4-chlorophenyl)-2-methyl-4-thieno[2,3-d]pyrimidinyl]amino]butanoate IUPAC Name: 4-[[5-(4-chlorophenyl)-2-methylthieno[2,3-d]pyrimidin-4-yl]amino]butanoate Traditional Name: 4-[[5-(4-chlorophenyl)-2-methyl-thieno[2,3-d]pyrimidin-4-yl]amino]butyrate Formula: C17H15ClN3O2S- MolecularWeight: 360.8379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)Cl)NCCCC(=O)[O-]

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC=C(C=C3)Cl)NCCCC(=O)[O-]

InChI

InChI=1S/C17H16ClN3O2S/c1-10-20-16(19-8-2-3-14(22)23)15-13(9-24-17(15)21-10)11-4-6-12(18)7-5-11/h4-7,9H,2-3,8H2,1H3,(H,22,23)(H,19,20,21)/p-1