N-(2-phenylazanyl-1,3-benzothiazol-4-yl)cycloheptanecarboxamide

Systemtic Name: N-(2-phenylazanyl-1,3-benzothiazol-4-yl)cycloheptanecarboxamide Openeye Name: N-(2-anilino-1,3-benzothiazol-4-yl)cycloheptanecarboxamide CAS Name: N-(2-anilino-1,3-benzothiazol-4-yl)cycloheptanecarboxamide IUPAC Name: N-(2-anilino-1,3-benzothiazol-4-yl)cycloheptanecarboxamide Traditional Name: N-(2-anilino-1,3-benzothiazol-4-yl)cycloheptanecarboxamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)NC2=C3C(=CC=C2)SC(=N3)NC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)C(=O)NC2=C3C(=CC=C2)SC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS/c25-20(15-9-4-1-2-5-10-15)23-17-13-8-14-18-19(17)24-21(26-18)22-16-11-6-3-7-12-16/h3,6-8,11-15H,1-2,4-5,9-10H2,(H,22,24)(H,23,25)