N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-thiazolyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]phenyl]cyclopropanecarboxamide Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=CSC(=N3)C4=CC(=CC=C4)NC(=O)C5CC5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=CSC(=N3)C4=CC(=CC=C4)NC(=O)C5CC5)OC1

InChI

InChI=1S/C22H20N2O3S/c25-21(14-5-6-14)23-17-4-1-3-16(11-17)22-24-18(13-28-22)15-7-8-19-20(12-15)27-10-2-9-26-19/h1,3-4,7-8,11-14H,2,5-6,9-10H2,(H,23,25)