3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide CAS Name: 3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide IUPAC Name: 3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-sulfanylidene-3H-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3-[[2-(3,4-dimethylphenyl)cyclopropyl]amino]-N-(2-thioxo-3H-1,3-benzothiazol-6-yl)benzamide Formula: C25H23N3OS2 MolecularWeight: 445.59962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2CC2NC3=CC=CC(=C3)C(=O)NC4=CC5=C(C=C4)NC(=S)S5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2CC2NC3=CC=CC(=C3)C(=O)NC4=CC5=C(C=C4)NC(=S)S5)C

InChI

InChI=1S/C25H23N3OS2/c1-14-6-7-16(10-15(14)2)20-13-22(20)26-18-5-3-4-17(11-18)24(29)27-19-8-9-21-23(12-19)31-25(30)28-21/h3-12,20,22,26H,13H2,1-2H3,(H,27,29)(H,28,30)