5-(2-azanylpyrimidin-4-yl)-N-(4-chloranyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

Systemtic Name: 5-(2-azanylpyrimidin-4-yl)-N-(4-chloranyl-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Openeye Name: 5-(2-aminopyrimidin-4-yl)-N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 5-(2-amino-4-pyrimidinyl)-N-(4-chloro-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 5-(2-aminopyrimidin-4-yl)-N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 5-(2-aminopyrimidin-4-yl)-N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C16H10ClN5OS2 MolecularWeight: 387.8665

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)NC(=O)C3=CC=C(S3)C4=NC(=NC=C4)N

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)NC(=O)C3=CC=C(S3)C4=NC(=NC=C4)N

InChI

InChI=1S/C16H10ClN5OS2/c17-8-2-1-3-11-13(8)21-16(25-11)22-14(23)12-5-4-10(24-12)9-6-7-19-15(18)20-9/h1-7H,(H2,18,19,20)(H,21,22,23)