N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H21BrN4O3S MolecularWeight: 453.35334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CC2)SCC(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CC(C)C1=NN=C(N1C2CC2)SCC(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C18H21BrN4O3S/c1-10(2)17-21-22-18(23(17)11-3-4-11)27-9-16(24)20-13-8-15-14(7-12(13)19)25-5-6-26-15/h7-8,10-11H,3-6,9H2,1-2H3,(H,20,24)