3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-phenyl-2-phenylazanyl-1,3-thiazol-5-yl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(4-phenyl-2-phenylazanyl-1,3-thiazol-5-yl)methanone Openeye Name: (2-anilino-4-phenyl-thiazol-5-yl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone CAS Name: (2-anilino-4-phenyl-5-thiazolyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone IUPAC Name: (2-anilino-4-phenyl-1,3-thiazol-5-yl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone Traditional Name: (2-anilino-4-phenyl-thiazol-5-yl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanone Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)C3=C(N=C(S3)NC4=CC=CC=C4)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)C3=C(N=C(S3)NC4=CC=CC=C4)C5=CC=CC=C5)OC1

InChI

InChI=1S/C25H20N2O3S/c28-23(18-12-13-20-21(16-18)30-15-7-14-29-20)24-22(17-8-3-1-4-9-17)27-25(31-24)26-19-10-5-2-6-11-19/h1-6,8-13,16H,7,14-15H2,(H,26,27)