4-bromanyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 4-bromanyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: N-benzyl-4-bromo-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)thiazole-5-carboxamide CAS Name: 4-bromo-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-N-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: N-benzyl-4-bromo-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1,3-thiazole-5-carboxamide Traditional Name: N-benzyl-4-bromo-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)thiazole-5-carboxamide Formula: C19H16BrN3O3S MolecularWeight: 446.31764

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=C(S3)C(=O)NCC4=CC=CC=C4)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=C(S3)C(=O)NCC4=CC=CC=C4)Br

InChI

InChI=1S/C19H16BrN3O3S/c20-17-16(18(24)21-11-12-4-2-1-3-5-12)27-19(23-17)22-13-6-7-14-15(10-13)26-9-8-25-14/h1-7,10H,8-9,11H2,(H,21,24)(H,22,23)